 Entering Gaussian System, Link 0=g16
 Input=06_betapinene_STD_B3LYPDBJ-def2SVPDr.in
 Output=06_betapinene_STD_B3LYPDBJ-def2SVPDr.log
 AtFile(1): /user/pierpa/basis_sets/def2SVPD.gbs
            -H     0
            S    3   1.00
                 13.0107010              0.19682158D-01
                  1.9622572              0.13796524
                  0.44453796             0.47831935
            S    1   1.00
                  0.12194962             1.0000000
            P    1   1.00
                  0.8000000              1.0000000
            P    1   1.00
                  0.11704099050          1.0000000
            ****
            -He     0
            S    3   1.00
                 38.354936737            0.23814288905D-01
                  5.7689081479           0.15490906777
                  1.2399407035           0.46998096633
            S    1   1.00
                  0.29757815953          1.0000000
            P    1   1.00
                  1.0000000              1.0000000
            P    1   1.00
                  0.22039119441          1.0000000
            ****
            -Li     0
            S    5   1.00
                266.27785516             0.64920150325D-02
                 40.069783447            0.47747863215D-01
                  9.0559944389           0.20268796111
                  2.4503009051           0.48606574817
                  0.72209571855          0.43626977955
            S    1   1.00
                  0.52810884721D-01      1.0000000
            S    1   1.00
                  0.20960948798D-01      1.0000000
            P    2   1.00
                  1.4500000              0.2586000
                  0.3000000              1.0000000
            P    1   1.00
                  0.0820000              1.0000000
            P    1   1.00
                  0.26347662457D-01      1.0000000
            ****
            -Be     0
            S    5   1.00
                515.18616125             0.55615307983D-02
                 77.511037595            0.41190068062D-01
                 17.552481693            0.17913378108
                  4.8028940596           0.44736716455
                  1.4516214316           0.42009581920
            S    1   1.00
                  0.13281633620          1.0000000
            S    1   1.00
                  0.45837372213D-01      1.0000000
            P    3   1.00
                  3.6316917145          -0.29033998305D-01
                  0.71695694366         -0.16877854032
                  0.19541932860         -0.51403419628
            P    1   1.00
                  0.60515465890D-01      1.0000000
            P    1   1.00
                  0.30181880660D-01      1.0000000
            ****
            -B     0
            S    5   1.00
                839.31830086            -0.55929201074D-02
                126.26464843            -0.41565520771D-01
                 28.620600763           -0.18299816983
                  7.8793722710          -0.46540391866
                  2.4088857172          -0.44173884791
            S    1   1.00
                  0.25105109036          1.0000000
            S    1   1.00
                  0.83648866069D-01      1.0000000
            S    1   1.00
                  0.42351565332D-01      1.0000000
            P    3   1.00
                  6.0332223619          -0.35603672456D-01
                  1.2499157866          -0.19895775769
                  0.33871676350         -0.50850202618
            P    1   1.00
                  0.96415632351D-01      1.0000000
            D    1   1.00
                  0.5000000              1.0000000
            D    1   1.00
                  0.74392443101D-01      1.0000000
            ****
            -C     0
            S    5   1.00
               1238.4016938              0.54568832082D-02
                186.29004992             0.40638409211D-01
                 42.251176346            0.18025593888
                 11.676557932            0.46315121755
                  3.5930506482           0.44087173314
            S    1   1.00
                  0.40245147363          1.0000000
            S    1   1.00
                  0.13090182668          1.0000000
            S    1   1.00
                  0.67053540256D-01      1.0000000
            P    3   1.00
                  9.4680970621           0.38387871728D-01
                  2.0103545142           0.21117025112
                  0.54771004707          0.51328172114
            P    1   1.00
                  0.15268613795          1.0000000
            D    1   1.00
                  0.8000000              1.0000000
            D    1   1.00
                  0.11713185140          1.0000000
            ****
            -N     0
            S    5   1.00
               1712.8415853             -0.53934125305D-02
                257.64812677            -0.40221581118D-01
                 58.458245853           -0.17931144990
                 16.198367905           -0.46376317823
                  5.0052600809          -0.44171422662
            S    1   1.00
                  0.58731856571          1.0000000
            S    1   1.00
                  0.18764592253          1.0000000
            S    1   1.00
                  0.96171241529D-01      1.0000000
            P    3   1.00
                 13.571470233           -0.40072398852D-01
                  2.9257372874          -0.21807045028
                  0.79927750754         -0.51294466049
            P    1   1.00
                  0.21954348034          1.0000000
            D    1   1.00
                  1.0000000              1.0000000
            D    1   1.00
                  0.16697708112          1.0000000
            ****
            -O     0
            S    5   1.00
               2266.1767785             -0.53431809926D-02
                340.87010191            -0.39890039230D-01
                 77.363135167           -0.17853911985
                 21.479644940           -0.46427684959
                  6.6589433124          -0.44309745172
            S    1   1.00
                  0.80975975668          1.0000000
            S    1   1.00
                  0.25530772234          1.0000000
            S    1   1.00
                  0.76572453250D-01      1.0000000
            P    3   1.00
                 17.721504317            0.43394573193D-01
                  3.8635505440           0.23094120765
                  1.0480920883           0.51375311064
            P    1   1.00
                  0.27641544411          1.0000000
            P    1   1.00
                  0.69002276350D-01      1.0000000
            D    1   1.00
                  1.2000000              1.0000000
            D    1   1.00
                  0.17992024323          1.0000000
            ****
            -F     0
            S    5   1.00
               2894.8325990             -0.53408255515D-02
                435.41939120            -0.39904258866D-01
                 98.843328866           -0.17912768038
                 27.485198001           -0.46758090825
                  8.5405498171          -0.44653131020
            S    1   1.00
                  1.0654578038           1.0000000
            S    1   1.00
                  0.33247346748          1.0000000
            S    1   1.00
                  0.98097752264D-01      1.0000000
            P    3   1.00
                 22.696633924           -0.45212874436D-01
                  4.9872339257          -0.23754317067
                  1.3491613954          -0.51287353587
            P    1   1.00
                  0.34829881977          1.0000000
            P    1   1.00
                  0.83372148304D-01      1.0000000
            D    1   1.00
                  1.4000000              1.0000000
            D    1   1.00
                  0.22301361948          1.0000000
            ****
            -Ne     0
            S    5   1.00
               3598.9736625             -0.53259297003D-02
                541.32073112            -0.39817417969D-01
                122.90450062            -0.17914358188
                 34.216617022           -0.46893582977
                 10.650584124           -0.44782537577
            S    1   1.00
                  1.3545953960           1.0000000
            S    1   1.00
                  0.41919362639          1.0000000
            S    1   1.00
                  0.12055043545          1.0000000
            P    3   1.00
                 28.424053785           -0.46031944795D-01
                  6.2822510953          -0.23993183041
                  1.6978715079          -0.50871724964
            P    1   1.00
                  0.43300700172          1.0000000
            P    1   1.00
                  0.10141942051          1.0000000
            D    1   1.00
                  1.8880000              1.0000000
            D    1   1.00
                  0.28026803041          1.0000000
            ****
            -Na     0
            S    5   1.00
               4098.2003908             -0.58535911879D-02
                616.49374031            -0.43647161872D-01
                139.96644001            -0.19431465884
                 39.073441051           -0.48685065731
                 11.929847205           -0.41881705137
            S    3   1.00
                 20.659966030            0.85949689854D-01
                  1.9838860978          -0.56359144041
                  0.64836323942         -0.51954009048
            S    1   1.00
                  0.52443967404D-01      1.0000000
            S    1   1.00
                  0.28048160742D-01      1.0000000
            P    5   1.00
                 75.401862017            0.154353625324D-01
                 17.274818978            0.997382931840D-01
                  5.1842347425           0.312095939659
                  1.6601211973           0.492956748074
                  0.51232528958          0.324203983180
            P    1   1.00
                  0.0520000              1.0000000
            P    1   1.00
                  0.19853008514D-01      1.0000000
            D    1   1.00
                  0.1310000              1.0000000
            ****
            -Mg     0
            S    5   1.00
               4953.8339196             -0.57778967498D-02
                745.18044154            -0.43124761082D-01
                169.21604972            -0.19268216987
                 47.300672019           -0.48641439116
                 14.461336973           -0.42550894077
            S    3   1.00
                 24.768174789            0.87956969984D-01
                  2.4940945349          -0.55165058128
                  0.87807584533         -0.53443294833
            S    1   1.00
                  0.87212782497D-01      1.0000000
            S    1   1.00
                  0.33599293780D-01      1.0000000
            P    5   1.00
                 98.053010494           -0.14480564601D-01
                 22.586932277           -0.95495750787D-01
                  6.8391509842          -0.30787672651
                  2.2332843818          -0.49936292886
                  0.71606599387         -0.31503476213
            P    1   1.00
                  0.18914796195          1.0000000
            P    1   1.00
                  0.53768755187D-01      1.0000000
            P    1   1.00
                  0.23963578287D-01      1.0000000
            D    1   1.00
                  0.1010000              1.0000000
            ****
            -Al     0
            S    5   1.00
               5887.5727030              0.13483347987D-02
                885.61225996             0.10071576809D-01
                201.13604899             0.45132454056D-01
                 56.284974674            0.11461268043
                 17.229551243            0.10159608943
            S    3   1.00
                 29.340249922            0.69347454208D-01
                  3.0439630420          -0.42528117679
                  1.1285539518          -0.41449832210
            S    1   1.00
                  0.14234175160          1.0000000
            S    1   1.00
                  0.54400192313D-01      1.0000000
            S    1   1.00
                  0.32535359511D-01      1.0000000
            P    5   1.00
                145.11918809             0.63963373134D-02
                 33.717894833            0.44189359965D-01
                 10.369863083            0.15581575993
                  3.5135616036           0.28635286951
                  1.1980050273           0.22921423248
            P    1   1.00
                  0.26583005913          1.0000000
            P    1   1.00
                  0.71003361994D-01      1.0000000
            D    1   1.00
                  0.3000000              1.0000000
            D    1   1.00
                  0.53071685831D-01      1.0000000
            ****
            -Si     0
            S    5   1.00
               6903.7118686              0.13373962995D-02
               1038.4346419              0.99966546241D-02
                235.87581480             0.44910165101D-01
                 66.069385169            0.11463638540
                 20.247945761            0.10280063858
            S    3   1.00
                 34.353481730            0.70837285010D-01
                  3.6370788192          -0.43028836252
                  1.4002048599          -0.41382774969
            S    1   1.00
                  0.20484414805          1.0000000
            S    1   1.00
                  0.77994095468D-01      1.0000000
            S    1   1.00
                  0.46834778282D-01      1.0000000
            P    5   1.00
                179.83907373             0.61916656462D-02
                 41.907258846            0.43399431982D-01
                 12.955294367            0.15632019351
                  4.4383267393           0.29419996982
                  1.5462247904           0.23536823814
            P    1   1.00
                  0.35607612302          1.0000000
            P    1   1.00
                  0.10008513762          1.0000000
            D    1   1.00
                  0.3500000              1.0000000
            D    1   1.00
                  0.74117707708D-01      1.0000000
            ****
            -P     0
            S    5   1.00
               8002.4795106              0.57503489302D-02
               1203.6813590              0.43007628959D-01
                273.44227031             0.19363986252
                 76.655541517            0.49651693399
                 23.516927435            0.44983262479
            S    3   1.00
                 39.791683439            0.95188129789D-01
                  4.2770343323          -0.57649840368
                  1.6940256888          -0.54239583865
            S    1   1.00
                  0.27567674644          1.0000000
            S    1   1.00
                  0.10495590099          1.0000000
            S    1   1.00
                  0.64309734755D-01      1.0000000
            P    5   1.00
                219.50755823             0.92100565257D-02
                 51.274155030            0.65409765745D-01
                 15.921595892            0.24033730279
                  5.5069913481           0.46318321788
                  1.9537719426           0.37392563382
            P    1   1.00
                  0.47803397932          1.0000000
            P    1   1.00
                  0.13657952621          1.0000000
            D    1   1.00
                  0.4500000              1.0000000
            D    1   1.00
                  0.99587311089D-01      1.0000000
            ****
            -S     0
            S    5   1.00
               9184.9303010             -0.22294387756D-02
               1381.5105503             -0.16683029937D-01
                313.87147580            -0.75262436116D-01
                 88.053870623           -0.19376827038
                 27.039914905           -0.17718020803
            S    3   1.00
                 45.648731303           -0.10736062573
                  4.9664522326           0.65066293018
                  2.0116242047           0.59712155354
            S    1   1.00
                  0.35661077013          1.0000000
            S    1   1.00
                  0.13507221477          1.0000000
            S    1   1.00
                  0.44999823506D-01      1.0000000
            P    5   1.00
                261.98233439            -0.92729929822D-02
                 61.306894736           -0.66547669241D-01
                 19.103729887           -0.24828595903
                  6.6567720378          -0.48703847402
                  2.3959635161          -0.39337850312
            P    1   1.00
                  0.61776161679          1.0000000
            P    1   1.00
                  0.16993376871          1.0000000
            P    1   1.00
                  0.41706793676D-01      1.0000000
            D    1   1.00
                  0.5500000              1.0000000
            D    1   1.00
                  0.10172853717          1.0000000
            ****
            -Cl     0
            S    5   1.00
              10449.8275660              0.19708362484D-02
               1571.7365221              0.14754727977D-01
                357.12065523             0.66679112875D-01
                100.25185935             0.17228924084
                 30.812727554            0.15883786100
            S    3   1.00
                 51.923789434           -0.10009298909
                  5.7045760975           0.60841752753
                  2.3508376809           0.54352153355
            S    1   1.00
                  0.44605124672          1.0000000
            S    1   1.00
                  0.16848856190          1.0000000
            S    1   1.00
                  0.55344229413D-01      1.0000000
            P    5   1.00
                307.66790569            -0.87801484118D-02
                 72.102015515           -0.63563355471D-01
                 22.532680262           -0.24016428276
                  7.8991765444          -0.47798866557
                  2.8767268321          -0.38515850005
            P    1   1.00
                  0.77459363955          1.0000000
            P    1   1.00
                  0.21037699698          1.0000000
            P    1   1.00
                  0.50046271086D-01      1.0000000
            D    1   1.00
                  0.6500000              1.0000000
            D    1   1.00
                  0.12284803390          1.0000000
            ****
            -Ar     0
            S    5   1.00
              11797.1197650              0.20214479973D-02
               1774.3522753              0.15139852688D-01
                403.18875733             0.68525400873D-01
                113.24933999             0.17762929207
                 34.835298193            0.16496495001
            S    3   1.00
                 58.614775042           -0.10343394000
                  6.4922045078           0.63133365899
                  2.7117014403           0.54887572301
            S    1   1.00
                  0.54412974538          1.0000000
            S    1   1.00
                  0.20517411136          1.0000000
            S    1   1.00
                  0.66442487045D-01      1.0000000
            P    5   1.00
                356.28707256            -0.87321783271D-02
                 83.593132866           -0.63680317444D-01
                 26.186704029           -0.24311906886
                  9.2257275925          -0.48956069653
                  3.3922754954          -0.39229190040
            P    1   1.00
                  0.94740534010          1.0000000
            P    1   1.00
                  0.25659135062          1.0000000
            P    1   1.00
                  0.59491455142D-01      1.0000000
            D    1   1.00
                  0.6960000              1.0000000
            D    1   1.00
                  0.14309493859          1.0000000
            ****
            -K     0
            S    6   1.00
              31478.7467640              0.39838653994D-02
               4726.8876066              0.30501759762D-01
               1075.4345353              0.15073752622
                303.39811023             0.51912939801
                 98.327112831            1.0366957005
                 33.636222177            0.76398963199
            S    3   1.00
                 65.639209962           -0.28242617106
                  7.3162592218           1.6914935860
                  2.8902580135           1.2965331953
            S    3   1.00
                  4.5459748965          -0.76343555273D-02
                  0.70404124062          0.25635718960D-01
                  0.28266888959          0.16606859208D-01
            S    1   1.00
                  0.29058164020D-01      1.0000000
            S    1   1.00
                  0.12111638157D-01      1.0000000
            P    5   1.00
                361.22492154             0.20906479823D-01
                 84.670222166            0.15043641740
                 26.469088236            0.55440061077
                  9.2658077615           1.0409009991
                  3.3423388293           0.67825341194
            P    3   1.00
                  1.5100876104           0.75248191146
                  0.56568375163          1.3708585031
                  0.20817008495          0.66047633079
            P    1   1.00
                  0.0417370              1.0000000
            P    1   1.00
                  0.16603217986D-01      1.0000000
            D    1   1.00
                  0.3530000              1.0000000
            D    1   1.00
                  0.0980000              1.0000000
            ****
            -Ca     0
            S    6   1.00
              35138.7139290              0.39482520740D-02
               5276.4111348              0.30234243552D-01
               1200.4692589              0.14952019681
                338.71810542             0.51597345713
                109.85385922             1.0339510296
                 37.608880299            0.76937933526
            S    3   1.00
                 73.107977555           -0.28268525011
                  8.2407705688           1.6796092142
                  3.2959812993           1.2803766016
            S    3   1.00
                  5.2341800914          -0.76868604561D-02
                  0.84187220515          0.25382375978D-01
                  0.36510294029          0.16512171511D-01
            S    1   1.00
                  0.51222402884D-01      1.0000000
            S    1   1.00
                  0.19825111408D-01      1.0000000
            P    5   1.00
                413.11313893             0.20327135354D-01
                 96.935786224            0.14730276362
                 30.372154659            0.54887167322
                 10.684776830            1.0440659818
                  3.8821258350           0.68653490684
            P    3   1.00
                  1.7993016295           0.75410246871
                  0.69189056530          1.3409296599
                  0.26364024096          0.56391989435
            P    1   1.00
                  0.0749790              1.0000000
            P    1   1.00
                  0.23809355789D-01      1.0000000
            D    3   1.00
                  5.4979093879           0.73770011433D-01
                  1.3177128032           0.26052853169
                  0.32188682649          0.45233836380
            D    1   1.00
                  0.70528614919D-01      1.0000000
            ****
            -Sc     0
            S    6   1.00
              38956.0818040              0.39293205858D-02
               5849.5733637              0.30093221229D-01
               1330.8813154              0.14890370950
                375.55534165             0.51464282906
                121.87261370             1.0337708070
                 41.760243729            0.77436851627
            S    3   1.00
                 81.060633953           -0.28318552316
                  9.2059823972           1.6770806984
                  3.7063215732           1.2594733678
            S    3   1.00
                  5.9888909988          -0.77821367493D-02
                  0.97363432378          0.25499692745D-01
                  0.42041019223          0.16191560820D-01
            S    1   1.00
                  0.59440551913D-01      1.0000000
            S    1   1.00
                  0.22897806303D-01      1.0000000
            P    5   1.00
                466.31481262             0.19984300385D-01
                109.51217097             0.14561043072
                 34.375921827            0.54687466223
                 12.142096955            1.0479006012
                  4.4336767669           0.68894890327
            P    3   1.00
                  2.0971291866           0.75619214724
                  0.80977606956          1.3178212235
                  0.30834046588          0.54312268173
            P    1   1.00
                  0.0897480              1.0000000
            P    1   1.00
                  0.28148150384D-01      1.0000000
            D    4   1.00
                 19.240334928            0.27039082144D-01
                  5.1178995899           0.13803684743
                  1.6554278827           0.34869086403
                  0.54016355610          0.48594185717
            D    1   1.00
                  0.16211214518           .34374449689
            F    1   1.00
                  0.3450000              1.0000000
            ****
            -Ti     0
            S    6   1.00
              42961.5121850              0.39127635355D-02
               6450.9759169              0.29969820489D-01
               1467.7210915              0.14836352707
                414.20997355             0.51347285324
                134.48715840             1.0335365483
                 46.122209796            0.77854233930
            S    3   1.00
                 89.447762543           -0.28385401259
                 10.223346060            1.6772785333
                  4.1353774271           1.2411928456
            S    3   1.00
                  6.7896181452          -0.78399994518D-02
                  1.1106730691           0.25495493019D-01
                  0.47565975578          0.16061172892D-01
            S    1   1.00
                  0.65986956934D-01      1.0000000
            S    1   1.00
                  0.25210342250D-01      1.0000000
            P    5   1.00
                522.03684782             0.19754179642D-01
                122.68649489             0.14460677619
                 38.572903611            0.54669004165
                 13.672169319            1.0531647540
                  5.0118529359           0.69111213363
            P    3   1.00
                  2.4131928282           0.75803437136
                  0.93252270050          1.3036241399
                  0.35429058390          0.53638653300
            P    1   1.00
                  0.1015610              1.0000000
            P    1   1.00
                  0.35788253200D-01      1.0000000
            D    4   1.00
                 23.465125957            0.26536380115D-01
                  6.3332593832           0.13796453963
                  2.0766489946           0.35312644228
                  0.69027361954          0.48647124166
            D    1   1.00
                  0.21088738554           .33026314258
            F    1   1.00
                  0.5620000              1.0000000
            ****
            -V     0
            S    6   1.00
              47160.3760600              0.14498688908D-02
               7081.4110871              0.11106435251D-01
               1611.1621223              0.55005423585D-01
                454.72940551             0.19060252591
                147.71321208             0.38435022957
                 50.699538950            0.29095546792
            S    3   1.00
                 98.262492669           -0.10942337856
                 11.294293099            0.64539490399
                  4.5853360105           0.47117880777
            S    3   1.00
                  7.6359689588          -0.22454949054
                  1.2539836689           0.72594852764
                  0.53271935387          0.45560582748
            S    1   1.00
                  0.72246239566D-01      1.0000000
            S    1   1.00
                  0.27358087448D-01      1.0000000
            P    5   1.00
                580.55044988             0.97315110917D-02
                136.52341127             0.71531241137D-01
                 42.983958820            0.27197688414
                 15.282798763            0.52618988893
                  5.6202495154           0.34452533498
            P    3   1.00
                  2.7485386415           0.34040396496
                  1.0618550073           0.57983996120
                  0.40235518645          0.23911643083
            P    1   1.00
                  0.1112480              1.0000000
            P    1   1.00
                  0.35000888460D-01      1.0000000
            D    4   1.00
                 27.358434017            0.26641927050D-01
                  7.4540604253           0.13995311726
                  2.4633917847           0.35751066639
                  0.82480925277          0.48488354148
            D    1   1.00
                  0.25257904742           .32332844995
            F    1   1.00
                  0.8310000              1.0000000
            ****
            -Cr     0
            S    6   1.00
              51528.0863490              0.14405823106D-02
               7737.2103487              0.11036202287D-01
               1760.3748470              0.54676651806D-01
                496.87706544             0.18965038103
                161.46520598             0.38295412850
                 55.466352268            0.29090050668
            S    3   1.00
                107.54732999            -0.10932281100
                 12.408671897            0.64472599471
                  5.0423628826           0.46262712560
            S    3   1.00
                  8.5461640165          -0.22711013286
                  1.3900441221           0.73301527591
                  0.56066602876          0.44225565433
            S    1   1.00
                  0.71483705972D-01      1.0000000
            S    1   1.00
                  0.28250687604D-01      1.0000000
            P    5   1.00
                640.48536096             0.96126715203D-02
                150.69711194             0.70889834655D-01
                 47.503755296            0.27065258990
                 16.934120165            0.52437343414
                  6.2409680590           0.34107994714
            P    3   1.00
                  3.0885463206           0.33973986903
                  1.1791047769           0.57272062927
                  0.43369774432          0.24582728206
            P    1   1.00
                  0.1206750              1.0000000
            P    1   1.00
                  0.33978554488D-01      1.0000000
            D    4   1.00
                 27.559479426            0.30612488044D-01
                  7.4687020327           0.15593270944
                  2.4345903574           0.36984421276
                  0.78244754808          0.47071118077
            D    1   1.00
                  0.21995774311           .33941649889
            F    1   1.00
                  1.1470000              1.0000000
            ****
            -Mn     0
            S    6   1.00
              56137.0090370              0.14321304702D-02
               8429.2063943              0.10972509162D-01
               1917.8277233              0.54382468712D-01
                541.36230198             0.18884335129
                176.00069142             0.38198025054
                 60.500477010            0.29156772596
            S    3   1.00
                117.17282882            -0.10933661328
                 13.596973368            0.64305039431
                  5.5483996341           0.45848970584
            S    3   1.00
                  9.4662853530          -0.22538977259
                  1.5595006070           0.72307758657
                  0.65230205868          0.45300721536
            S    1   1.00
                  0.84003734475D-01      1.0000000
            S    1   1.00
                  0.31256098581D-01      1.0000000
            P    5   1.00
                706.00497535             0.95055518167D-02
                166.19728820             0.70356271142D-01
                 52.452061906            0.27005556982
                 18.746932862            0.52574344602
                  6.9282991622           0.34254033223
            P    3   1.00
                  3.4772204938           0.33994073736
                  1.3406906449           0.57203836254
                  0.50498803038          0.23847605831
            P    1   1.00
                  0.1276500              1.0000000
            P    1   1.00
                  0.36336999053D-01      1.0000000
            D    4   1.00
                 35.423264935            0.26985304111D-01
                  9.7814221451           0.14383458648
                  3.2673488767           0.36418958377
                  1.1026472189           0.48152670661
            D    1   1.00
                  0.33743205934           .31458754360
            F    1   1.00
                  1.3260000              1.0000000
            ****
            -Fe     0
            S    6   1.00
              60923.6406430              0.14302254466D-02
               9147.8893982              0.10958790038D-01
               2081.3505927              0.54332554248D-01
                587.55977067             0.18884995009
                191.09043990             0.38253069946
                 65.732730112            0.29308335984
            S    3   1.00
                127.25891928            -0.10964564925
                 14.830913010            0.64387631332
                  6.0653307408           0.45472347323
            S    3   1.00
                 10.449943710           -0.22539639952
                  1.7245228003           0.72164398156
                  0.71772177325          0.44985492922
            S    1   1.00
                  0.91449828308D-01      1.0000000
            S    1   1.00
                  0.33706691021D-01      1.0000000
            P    5   1.00
                773.43750995             0.94325735144D-02
                182.15149714             0.70029620575D-01
                 57.547272758            0.26993651996
                 20.614988935            0.52700011047
                  7.6348557890           0.34284148028
            P    3   1.00
                  3.8719327990           0.33974402988
                  1.4924724132           0.56842594005
                  0.56061284958          0.23649365839
            P    1   1.00
                  0.1349150              1.0000000
            P    1   1.00
                  0.36933633962D-01      1.0000000
            D    4   1.00
                 38.968133419            0.27879664382D-01
                 10.800067078            0.14858319982
                  3.6136457999           0.36905479496
                  1.2129967888           0.47745100883
            D    1   1.00
                  0.36524393170           .31418142304
            F    1   1.00
                  1.5980000              1.0000000
            ****
            -Co     0
            S    6   1.00
              65902.2082570              0.14284614936D-02
               9895.3896027              0.10946072783D-01
               2251.4305789              0.54285953890D-01
                635.61097084             0.18885179079
                206.78820681             0.38301634994
                 71.179242971            0.29443551266
            S    3   1.00
                137.77268040            -0.10990221736
                 16.118079243            0.64455537395
                  6.6030327710           0.45116787924
            S    3   1.00
                 11.479915788           -0.22593846910
                  1.8956426324           0.72231409008
                  0.78466232067          0.44903812296
            S    1   1.00
                  0.98425774432D-01      1.0000000
            S    1   1.00
                  0.35945741932D-01      1.0000000
            P    5   1.00
                843.64358575             0.93866097254D-02
                198.76386994             0.69880208716D-01
                 62.854963098            0.27037070345
                 22.562842280            0.52904786880
                  8.3713209127           0.34357029579
            P    3   1.00
                  4.2858719800           0.34027999036
                  1.6508041817           0.56693392384
                  0.61834231096          0.23617979783
            P    1   1.00
                  0.1413080              1.0000000
            P    1   1.00
                  0.37744197011D-01      1.0000000
            D    4   1.00
                 42.927867612            0.28487788365D-01
                 11.942533053            0.15206951283
                  4.0046495664           0.37310913999
                  1.3413193804           0.47549837676
            D    1   1.00
                  0.40015009743           .31346831424
            F    1   1.00
                  1.9030000              1.0000000
            ****
            -Ni     0
            S    6   1.00
              71074.8032110              0.14260386729D-02
              10672.0209410              0.10928236994D-01
               2428.1389007              0.54212626938D-01
                685.53595148             0.18874768902
                223.10072863             0.38324616985
                 76.842014042            0.29550637144
            S    3   1.00
                148.71122016            -0.11014443059
                 17.459154987            0.64521426988
                  7.1625280665           0.44797838103
            S    3   1.00
                 12.556137125           -0.22645403224
                  2.0735740488           0.72320959286
                  0.85382640602          0.44868026476
            S    1   1.00
                  0.10536766271          1.0000000
            S    1   1.00
                  0.38134087688D-01      1.0000000
            P    5   1.00
                916.73608662             0.93439635610D-02
                216.06139913             0.69737374902D-01
                 68.383914817            0.27073495012
                 24.593843952            0.53078301549
                  9.1392960204           0.34410229438
            P    3   1.00
                  4.7193371746           0.34076082016
                  1.8161849234           0.56580169611
                  0.67840750720          0.23616717361
            P    1   1.00
                  0.1465880              1.0000000
            P    1   1.00
                  0.38905548722D-01      1.0000000
            D    4   1.00
                 47.093832108            0.28982316948D-01
                 13.146463975            0.15494995950
                  4.4170548925           0.37633115111
                  1.4771565078           0.47365096014
            D    1   1.00
                  0.43735921792           .31247837833
            F    1   1.00
                  2.1740000              1.0000000
            ****
            -Cu     0
            S    6   1.00
              76381.3480560              0.14336079896D-02
              11468.7774990              0.10986749865D-01
               2609.4246495              0.54513652465D-01
                736.75033098             0.18990128258
                239.82419958             0.38581959211
                 82.656829252            0.29790607498
            S    3   1.00
                160.13544196            -0.11146778567
                 18.834177695            0.65349301031
                  7.7176595741           0.44770534421
            S    3   1.00
                 13.710846717           -0.22870911122
                  2.2349895670           0.73464423031
                  0.87818360069          0.43273070874
            S    1   1.00
                  0.87187458064D-01      1.0000000
            S    1   1.00
                  0.32969114665D-01      1.0000000
            P    5   1.00
                991.24075782             0.93878498798D-02
                233.69376116             0.70208282458D-01
                 74.020930927            0.27323522220
                 26.664967447            0.53580792728
                  9.9192087478           0.34575794906
            P    3   1.00
                  5.1519553926           0.34229108083
                  1.9638205828           0.56456592484
                  0.71560097037          0.24078584318
            P    1   1.00
                  0.1550650              1.0000000
            P    1   1.00
                  0.38734214974D-01      1.0000000
            D    4   1.00
                 47.335049590            0.32375547758D-01
                 13.161666077            0.16810218684
                  4.3693777244           0.38477707982
                  1.4132925109           0.46147880178
            D    1   1.00
                  0.38878001452           .32388873258
            F    1   1.00
                  2.2330000              1.0000000
            ****
            -Zn     0
            S    6   1.00
              82000.7116290              0.14210764000D-02
              12312.4717770              0.10891499487D-01
               2801.3944193              0.54057188059D-01
                790.99424302             0.18847463904
                257.56551079             0.38346549346
                 88.814933400            0.29723794197
            S    3   1.00
                171.86353716            -0.11051849523
                 20.302534785            0.64607716984
                  8.3464123068           0.44220117322
            S    3   1.00
                 14.847536940           -0.22705309278
                  2.4495029507           0.72433217935
                  0.99845821824          0.44836495592
            S    1   1.00
                  0.11891307937          1.0000000
            S    1   1.00
                  0.42297428760D-01      1.0000000
            P    5   1.00
               1071.5185372              0.92767797235D-02
                252.69712152             0.69541149434D-01
                 80.100829126            0.27156772564
                 28.903393172            0.53401355573
                 10.768899879            0.34501323446
            P    3   1.00
                  5.6446212530           0.34129600164
                  2.1678291347           0.56390521973
                  0.80540898341          0.23676109735
            P    1   1.00
                  0.1624550              1.0000000
            P    1   1.00
                  0.42022716037D-01      1.0000000
            D    4   1.00
                 56.088939191            0.29588869140D-01
                 15.751908917            0.158725714045
                  5.3115812367           0.379762291591
                  1.7737904917           0.468989591719
            D    1   1.00
                  0.51975583665           .309071490776
            F    1   1.00
                  2.6140000              1.0000000
            ****
            -Ga     0
            S    6   1.00
              87842.1262960              0.14271588798D-02
              13189.4964020              0.10938894097D-01
               3000.9482141              0.54308200127D-01
                847.38425966             0.18951055983
                276.00980642             0.38615185918
                 95.216672071            0.30051082719
            S    3   1.00
                184.00703968            -0.11124461963
                 21.827051433            0.64831322918
                  9.0026963761           0.44358383594
            S    3   1.00
                 16.033176938           -0.23014299555
                  2.6707724878           0.72946861516
                  1.1252834170           0.46214976951
            S    1   1.00
                  0.15967608829          1.0000000
            S    1   1.00
                  0.57643044753D-01      1.0000000
            S    1   1.00
                  0.31819812628D-01      1.0000000
            P    5   1.00
               1167.2665844              0.90974021307D-02
                275.38062789             0.68456273343D-01
                 87.375073070            0.26922293888
                 31.597254670            0.53507897882
                 11.824122798            0.35279062760
            P    3   1.00
                  6.2881845133           0.33938244530
                  2.5199853240           0.56871947608
                  1.0169726306           0.27717694939
            P    1   1.00
                  0.24748373604          1.0000000
            P    1   1.00
                  0.66685294163D-01      1.0000000
            D    4   1.00
                 65.354237674            0.27370146382D-01
                 18.504656747            0.15099463976
                  6.3179620632           0.37485328545
                  2.1641389426           0.47510606851
            D    1   1.00
                  0.66693092754           .29843287401
            D    1   1.00
                  0.2070000              1.0000000
            D    1   1.00
                  0.49799390975D-01      1.0000000
            ****
            -Ge     0
            S    6   1.00
              93889.8366420              0.14233976060D-02
              14097.4975280              0.10910795654D-01
               3207.5477309              0.54183705943D-01
                905.76727269             0.18922820349
                295.11014693             0.38612847001
                101.84713141             0.30164050736
            S    3   1.00
                196.56719662            -0.11118770940
                 23.405292522            0.64616007369
                  9.6839116702           0.44188904568
            S    3   1.00
                 17.269736544           -0.23027421375
                  2.8964622160           0.73017169398
                  1.2553621412           0.46197222255
            S    1   1.00
                  0.20213081492          1.0000000
            S    1   1.00
                  0.73867910982D-01      1.0000000
            S    1   1.00
                  0.43410224935D-01      1.0000000
            P    5   1.00
               1259.2085995              0.90115464252D-02
                297.15626382             0.67986841689D-01
                 94.353387522            0.26853856488
                 34.176329677            0.53659649219
                 12.816139615            0.35633514961
            P    3   1.00
                  6.8471029784           0.33900693119
                  2.7717363939           0.56809365264
                  1.1458418175           0.27246539884
            P    1   1.00
                  0.30679631536          1.0000000
            P    1   1.00
                  0.89283644115D-01      1.0000000
            D    4   1.00
                 74.782168177            0.25755860205D-01
                 21.310849759            0.14536816132
                  7.3464792363           0.37134209859
                  2.5656271395           0.48002998436
            D    1   1.00
                  0.81981773070           .28978790744
            D    1   1.00
                  0.2460000              1.0000000
            D    1   1.00
                  0.66328328796D-01      1.0000000
            ****
            -As     0
            S    6   1.00
             100146.5255400              0.14258349617D-02
              15036.8617110              0.10930176963D-01
               3421.2902833              0.54294174610D-01
                966.16965717             0.18976078153
                314.87394026             0.38775195453
                108.70823790             0.30402812040
            S    3   1.00
                209.54238950            -0.11162094204
                 25.038221139            0.64697607762
                 10.390964343            0.44223608673
            S    3   1.00
                 18.555090093           -0.22994190569
                  3.1281217449           0.73319107613
                  1.3884885073           0.45533653943
            S    1   1.00
                  0.24714362141          1.0000000
            S    1   1.00
                  0.91429428670D-01      1.0000000
            S    1   1.00
                  0.55939685220D-01      1.0000000
            P    5   1.00
               1355.6443507              0.89182507898D-02
                319.99929270             0.67454750717D-01
                101.67734092             0.26759772110
                 36.886323845            0.53776844520
                 13.861115909            0.35992570244
            P    3   1.00
                  7.4260666912           0.34036849637
                  3.0316247187           0.57030149334
                  1.2783078340           0.26606170238
            P    1   1.00
                  0.37568503356          1.0000000
            P    1   1.00
                  0.11394805454          1.0000000
            D    4   1.00
                 84.445514539            0.24518402724D-01
                 24.190416102            0.14107454677
                  8.4045015119           0.36875228915
                  2.9808970748           0.48409561362
            D    1   1.00
                  0.97909243359           .28250268781
            D    1   1.00
                  0.2930000              1.0000000
            D    1   1.00
                  0.84097628016D-01      1.0000000
            ****
            -Se     0
            S    6   1.00
             106612.2002700              0.14274889113D-02
              16007.6047010              0.10943525114D-01
               3642.1699707              0.54374171596D-01
               1028.5912993              0.19018092947
                335.30298888             0.38913021696
                115.80129154             0.30620207088
            S    3   1.00
                222.93325020            -0.11198808009
                 26.726257934            0.64752124207
                 11.124501923            0.44241976651
            S    3   1.00
                 19.888520061           -0.22857227762
                  3.3668473803           0.73591359951
                  1.5249277839           0.44330199577
            S    1   1.00
                  0.29630037912          1.0000000
            S    1   1.00
                  0.11009288974          1.0000000
            S    1   1.00
                  0.42167294728D-01      1.0000000
            P    5   1.00
               1455.9068120              0.88203597043D-02
                343.75101831             0.66875851967D-01
                109.29554964             0.26640578080
                 39.707711022            0.53834928422
                 14.950185232            0.36303281993
            P    3   1.00
                  8.0208962094           0.34153807025
                  3.2934649756           0.57257906583
                  1.4058602438           0.25549813222
            P    1   1.00
                  0.45076123226          1.0000000
            P    1   1.00
                  0.13353413325          1.0000000
            P    1   1.00
                  0.34396697938D-01      1.0000000
            D    4   1.00
                 94.494024044            0.23490101098D-01
                 27.188185260            0.13747735767D+00
                  9.5091567352           0.36649929124D+00
                  3.4170516853           0.48750989884D+00
            D    1   1.00
                  1.1479590083            .27657943383D+00
            D    1   1.00
                  0.3380000              1.0000000
            D    1   1.00
                  0.82767380906D-01      1.0000000
            ****
            -Br     0
            S    6   1.00
             113286.3877600              0.14283037779D-02
              17009.6263030              0.10950417496D-01
               3870.1842567              0.54421006604D-01
               1093.0357227              0.19047907695
                356.39721797             0.39024642737
                123.12539643             0.30814432514
            S    3   1.00
                236.74084007            -0.11228065671
                 28.468661070            0.64775962312
                 11.883443722            0.44235575986
            S    3   1.00
                 21.269633312           -0.22642576323
                  3.6129226841           0.73823712008
                  1.6626648969           0.42683868694
            S    1   1.00
                  0.34823793232          1.0000000
            S    1   1.00
                  0.13019031394          1.0000000
            S    1   1.00
                  0.50966709763D-01      1.0000000
            P    5   1.00
               1560.2801881              0.87166669072D-02
                368.47859205             0.66243637420D-01
                117.22978849             0.26495610385
                 42.648909248            0.53839160587
                 16.087225096            0.36579387888
            P    3   1.00
                  8.6352810058           0.34248787366
                  3.5613665502           0.57500678213
                  1.5292626609           0.24330394172
            P    1   1.00
                  0.53064294848          1.0000000
            P    1   1.00
                  0.15702758965          1.0000000
            P    1   1.00
                  0.39636841846D-01      1.0000000
            D    4   1.00
                104.85518642             0.22650147581D-01
                 30.281143688            0.13455483230
                 10.651394267            0.36474454537
                  3.8699456233           0.49044587056
            D    1   1.00
                  1.3240876762            .27137289040
            D    1   1.00
                  0.3890000              1.0000000
            D    1   1.00
                  0.96543342393D-01      1.0000000
            ****
            -Kr     0
            S    6   1.00
             120165.6487500              0.14294234496D-02
              18042.5001690              0.10959597020D-01
               4105.1800388              0.54479647470D-01
               1159.4447248              0.19081239122
                378.13810346             0.39140445949
                130.67610045             0.31007346689
            S    3   1.00
                250.96373353            -0.11258604011
                 30.265930380            0.64816322524
                 12.668110757            0.44240238994
            S    3   1.00
                 22.697940101           -0.22391964908
                  3.8673017398           0.74060953026
                  1.8013706671           0.40803658445
            S    1   1.00
                  0.40308639136          1.0000000
            S    1   1.00
                  0.15170527749          1.0000000
            S    1   1.00
                  0.60450731670D-01      1.0000000
            P    5   1.00
               1668.5736623              0.86215009803D-02
                394.13862798             0.65665506884D-01
                125.46644854             0.26366576697
                 45.704992729            0.53867658574
                 17.270133229            0.36865167502
            P    3   1.00
                  9.2699487770           0.34346189015
                  3.8364617719           0.57784776196
                  1.6467163312           0.23075615197
            P    1   1.00
                  0.61479686489          1.0000000
            P    1   1.00
                  0.18319467414          1.0000000
            P    1   1.00
                  0.45792563991D-01      1.0000000
            D    4   1.00
                115.55868603             0.21945485333D-01
                 33.477985864            0.13211212879
                 11.834450207            0.36333306964
                  4.3408254894           0.49300484446
            D    1   1.00
                  1.5079273157            .26676858913
            D    1   1.00
                  0.4430000              1.0000000
            D    1   1.00
                  0.11235044486          1.0000000
            ****
            -Rb     0
            S    3   1.00
                  4.6687885071           0.29008526793
                  2.9442428420          -0.67740090428
                  0.58171262989          0.45712389487
            S    1   1.00
                  0.45147933555          1.0000000
            S    1   1.00
                  0.21604923532          1.0000000
            S    1   1.00
                  0.32088816526D-01      1.0000000
            S    1   1.00
                  0.13833878175D-01      1.0000000
            P    4   1.00
                  5.5234179480           0.51234729472D-01
                  3.4120149646          -0.17337025646
                  0.76899021792          0.43339683188
                  0.33088071786          0.55354332721
            P    1   1.00
                  0.13423268441          1.0000000
            P    1   1.00
                  0.20642679613D-01      1.0000000
            P    1   1.00
                  0.43243763156D-02      1.0000000
            D    1   1.00
                  0.2260000              1.0000000
            D    1   1.00
                  0.27432280711D-01      1.0000000
            ****
            -Sr     0
            S    3   1.00
                  5.9276428767           0.19698765364
                  3.0691274814          -0.64852205985
                  0.70675488028          0.62064729022
            S    1   1.00
                  0.33824024280          1.0000000
            S    1   1.00
                  0.61768869200D-01      1.0000000
            S    1   1.00
                  0.25767593093D-01      1.0000000
            P    4   1.00
                  2.4324720000          -0.37145059848
                  1.6642340000           0.37856824234
                  0.59455471858          0.59874487803
                  0.26152621998          0.35314019512
            P    1   1.00
                  0.10258814042          1.0000000
            P    1   1.00
                  0.33223404030D-01      1.0000000
            P    1   1.00
                  0.16570352270D-01      1.0000000
            D    4   1.00
                  3.6180810000          -0.75010000000D-02
                  0.99665600000          0.10809800000
                  0.39073500000          0.27854000000
                  0.12277000000          0.47731800000
            D    1   1.00
                  0.36655000000D-01       .44818300000
            ****
            -Y     0
            S    3   1.00
                  5.1329580000          -1.3864845457
                  4.2401920000           1.9459581166
                  1.2982800000           0.44182603154
            S    1   1.00
                  0.82904954347          1.0000000
            S    1   1.00
                  0.34752758911          1.0000000
            S    1   1.00
                  0.68418878574D-01      1.0000000
            S    1   1.00
                  0.27323992904D-01      1.0000000
            P    4   1.00
                  2.7279200000          -0.37249884911871
                  1.9790500000           0.32572065995957
                  0.79980886805          0.50094655502482
                  0.38409397354          0.44385929492812
            P    1   1.00
                  0.16173582264          1.0000000
            P    1   1.00
                  0.69700000000D-01      1.0000000
            P    1   1.00
                  0.0300000              1.0000000
            D    4   1.00
                  3.9030833060          -0.0098209792625124
                  1.1363234302           0.19183629664092
                  0.45617043877          0.40597788538820
                  0.17470950748          0.43861485518224
            D    1   1.00
                  0.61978796638D-01      1.0000000
            F    1   1.00
                  0.2651500              1.0000000
            ****
            -Zr     0
            S    3   1.00
                  5.8737890000           0.54255558714
                  4.2872700000          -0.95241333244
                  1.4641370000          -0.13703926411
            S    1   1.00
                  0.83727682345           .88521584390
            S    1   1.00
                  0.36849806511          1.0000000
            S    1   1.00
                  0.77806859124D-01      1.0000000
            S    1   1.00
                  0.30273088330D-01      1.0000000
            P    4   1.00
                  2.8742240000          -0.46624086918
                  2.1199010000           0.45883133891
                  0.78845821105          0.58853912475
                  0.36332579847          0.35822232244
            P    1   1.00
                  0.14951762021          1.0000000
            P    1   1.00
                  0.67000000000D-01      1.0000000
            P    1   1.00
                  0.30000000000D-01      1.0000000
            D    4   1.00
                  4.2898623878          -0.12212868080D-01
                  1.3615557498           0.19692423520
                  0.56937550689          0.42057831659
                  0.22674948677          0.42757027999
            D    1   1.00
                  0.83011031631D-01      1.0000000
            F    1   1.00
                  0.3926100              1.0000000
            ****
            -Nb     0
            S    3   1.00
                  6.5663010000          -0.94917907866
                  4.5864380000           1.5736372883
                  3.7537700000           0.36380422981
            S    1   1.00
                  0.84187717437          1.0000000
            S    1   1.00
                  0.38160666177          1.0000000
            S    1   1.00
                  0.85819911368D-01      1.0000000
            S    1   1.00
                  0.32702330370D-01      1.0000000
            P    4   1.00
                  3.0700630000          -0.51025115881
                  2.2379640000           0.53570598017
                  0.80801969671          0.63102216351
                  0.35783343432          0.30205908942
            P    1   1.00
                  0.13820085283          1.0000000
            P    1   1.00
                  0.70500000000D-01      1.0000000
            P    1   1.00
                  0.0360000              1.0000000
            D    4   1.00
                  4.6170975867          -0.13574476955D-01
                  1.5663438480           0.20374310496
                  0.66952425826          0.42997453105
                  0.27140946867          0.4179975484761
            D    1   1.00
                  0.10054426592          1.0000000
            F    1   1.00
                  0.5227000              1.0000000
            ****
            -Mo     0
            S    3   1.00
                  7.2033800000          -0.89310617237
                  5.0522950000           1.6074095756
                  2.9135330000           0.27804186088
            S    1   1.00
                  0.97858218681          1.0000000
            S    1   1.00
                  0.44369153753          1.0000000
            S    1   1.00
                  0.92150090705D-01      1.0000000
            S    1   1.00
                  0.34802246935D-01      1.0000000
            P    4   1.00
                  3.1518660000          -0.71873040872
                  2.4534820000           0.76442887870
                  0.85030192180          0.64808585640
                  0.36918237179          0.26792115234
            P    1   1.00
                  0.13490627460          1.0000000
            P    1   1.00
                  0.71800000000D-01      1.0000000
            P    1   1.00
                  0.38200000000D-01      1.0000000
            D    4   1.00
                  5.0044445497          -0.21587364862D-01
                  1.7736823324           0.20958680086
                  0.76950591696          0.43730880599
                  0.31530878939          0.41123927009
            D    1   1.00
                  0.11754374390          1.0000000
            F    1   1.00
                  0.6554500              1.0000000
            ****
            -Tc     0
            S    3   1.00
                  7.4344020000          -1.1436289973
                  5.5513270000           1.8752000559
                  3.0230860000           0.23952854431
            S    1   1.00
                  1.0647443990           1.0000000
            S    1   1.00
                  0.48127808497          1.0000000
            S    1   1.00
                  0.98299016952D-01      1.0000000
            S    1   1.00
                  0.36659977936D-01      1.0000000
            P    4   1.00
                  3.4490050000          -0.72277510434
                  2.6927370000           0.76458962802
                  0.94427370692          0.64533225171
                  0.41348148619          0.27195668811
            P    1   1.00
                  0.15488152305          1.0000000
            P    1   1.00
                  0.79000000000D-01      1.0000000
            P    1   1.00
                  0.40300000000D-01      1.0000000
            D    4   1.00
                  5.0906268699          -0.32176405405D-01
                  2.0156178510           0.21280802536
                  0.88113887240          0.44403309175
                  0.36427094833          0.40796933085
            D    1   1.00
                  0.13678402297          1.0000000
            F    1   1.00
                  0.7908500              1.0000000
            ****
            -Ru     0
            S    3   1.00
                  7.9365700000          -1.1772083350
                  5.9842450000           1.6197059592
                  4.8822200000           0.51065807556
            S    1   1.00
                  1.1031002163           1.0000000
            S    1   1.00
                  0.49818875261          1.0000000
            S    1   1.00
                  0.10678711393          1.0000000
            S    1   1.00
                  0.39191775872D-01      1.0000000
            P    4   1.00
                  3.7546090000          -0.70777873563
                  2.9165710000           0.74954391484
                  1.0322209568           0.64660609645
                  0.45249553774          0.27029086816
            P    1   1.00
                  0.16987042198          1.0000000
            P    1   1.00
                  0.85500000000D-01      1.0000000
            P    1   1.00
                  0.43000000000D-01      1.0000000
            D    4   1.00
                  5.7341846619          -0.35266111560D-01
                  2.2483686294           0.21802502222
                  0.98376978359          0.44709565013
                  0.40379445583          0.40371732508
            D    1   1.00
                  0.14978618173          1.0000000
            F    1   1.00
                  0.9431400              1.0000000
            ****
            -Rh     0
            S    3   1.00
                  7.9177440000           0.14014042010165D+01
                  6.8412070000          -0.17975072656312D+01
                  2.9598400000          -0.16225754496571
            S    1   1.00
                  1.3166643441            .87495110714057
            S    1   1.00
                  0.56907152172          1.0000000
            S    1   1.00
                  0.10059695193          1.0000000
            S    1   1.00
                  0.37071460798D-01      1.0000000
            P    4   1.00
                  4.1360790000          -0.55183328017626
                  2.9462810000           0.61370533515352
                  1.0792431924           0.64005434538256
                  0.46611217769          0.25958050755066
            P    1   1.00
                  0.17453169991          1.0000000
            P    1   1.00
                  0.84600000000D-01      1.0000000
            P    1   1.00
                  0.0410000              1.0000000
            D    4   1.00
                  6.8847131641          -0.15962387984517D-01
                  2.3837304391           0.23047555828858
                  1.0184384022           0.44075804027937
                  0.39957494644          0.39567661995894
            D    1   1.00
                  0.13951120264          1.0000000
            F    1   1.00
                  1.0949900              1.0000000
            ****
            -Pd     0
            S    3   1.00
                  8.4756400000           1.2392391076
                  7.1657170000          -1.6563109970
                  3.1821100000          -0.13178619060
            S    1   1.00
                  1.3973644196           1.0000000
            S    1   1.00
                  0.60532955868          1.0000000
            S    1   1.00
                  0.10229514209          1.0000000
            S    1   1.00
                  0.37338972881D-01      1.0000000
            P    4   1.00
                  4.2460970000          -0.82324104973
                  3.3925940000           0.87084659933
                  1.1975891264           0.63512225791
                  0.52673750585          0.27225338752
            P    1   1.00
                  0.20607094098          1.0000000
            P    1   1.00
                  0.87300000000D-01      1.0000000
            P    1   1.00
                  0.37000000000D-01      1.0000000
            D    4   1.00
                  7.3613290985          -0.17199885828D-01
                  2.6291037258           0.23313745275
                  1.1292744634           0.44536385867
                  0.44471659896          0.39293650406
            D    1   1.00
                  0.15544893836          1.0000000
            F    1   1.00
                  1.2462900              1.0000000
            ****
            -Ag     0
            S    3   1.00
                  9.0884420000          -1.9808918797
                  7.5407310000           2.7554513347
                  2.7940050000           0.22715408381
            S    1   1.00
                  1.4918135849           1.0000000
            S    1   1.00
                  0.63579159445          1.0000000
            S    1   1.00
                  0.10368414161          1.0000000
            S    1   1.00
                  0.37460004363D-01      1.0000000
            P    4   1.00
                  4.4512400000          -0.99352103771
                  3.6752630000           1.0500525237
                  1.2610620905           0.64747532537
                  0.54212477498          0.25621550723
            P    1   1.00
                  0.20221617026          1.0000000
            P    1   1.00
                  0.91300000000D-01      1.0000000
            P    1   1.00
                  0.0412000              1.0000000
            D    4   1.00
                  7.7956672292          -0.17042912377D-01
                  2.8926510238           0.23446154803
                  1.2474273203           0.44765877533
                  0.49313817671          0.39064954560
            D    1   1.00
                  0.17285032603          1.0000000
            F    1   1.00
                  1.3971100              1.0000000
            ****
            -Cd     0
            S    3   1.00
                  9.7270110000          -1.7930075316
                  7.8375230000           2.6110318971
                  5.0891940000           0.10748428949
            S    1   1.00
                  1.4981738327           1.0000000
            S    1   1.00
                  0.67281383129          1.0000000
            S    1   1.00
                  0.13297424875          1.0000000
            S    1   1.00
                  0.46915090488D-01      1.0000000
            P    4   1.00
                  4.7427160000          -1.0411923051
                  3.9366550000           1.1003682332
                  1.3569243142           0.65366639411
                  0.58791569541          0.24632369113
            P    1   1.00
                  0.21371239619          1.0000000
            P    1   1.00
                  0.10500000000          1.0000000
            P    1   1.00
                  0.0516000              1.0000000
            D    4   1.00
                  7.8631040859          -0.21376239365D-01
                  3.2935059133           0.22596399568
                  1.4503676025           0.45294402972
                  0.59373316766          0.39218971958231D+00
            D    1   1.00
                  0.21760141520          1.0000000
            F    1   1.00
                  1.5981300              1.0000000
            ****
            -In     0
            S    6   1.00
                283.52297445             0.70132141424D-03
                 23.324282101           -0.90887432418D-01
                 16.868026844            0.28096825177
                  6.7866498137          -0.70697832452
                  1.6782596016           0.98671644913
                  0.78396870439          0.62568576302
            S    2   1.00
                  1.8276654775          -0.34151640249
                  0.83753492534         -0.59696724334
            S    1   1.00
                  0.16643068973          1.0000000
            S    1   1.00
                  0.61143742809D-01      1.0000000
            S    1   1.00
                  0.25528481617D-01      1.0000000
            P    4   1.00
                 14.699191826            0.92248042349D-01
                  8.8709038051          -0.32437029300
                  1.1342905889           0.61162217018
                  0.52667652433          0.17609640386
            P    1   1.00
                  2.3284433667           1.0000000
            P    1   1.00
                  0.16859144934          1.0000000
            P    1   1.00
                  0.50070381081D-01      1.0000000
            D    5   1.00
                 31.378655926            0.54007004722D-02
                 18.290046326           -0.11208558948D-01
                  3.2551894590           0.30384519161
                  1.3874842584           0.54078109979
                  0.54248962672          0.38232680038
            D    1   1.00
                  0.18000000000          1.0000000
            D    1   1.00
                  0.41325112998D-01      1.0000000
            ****
            -Sn     0
            S    6   1.00
                375.95156177             0.15224884228D-02
                 23.661818008           -0.16776065030
                 19.946281315            0.33989090393
                  6.8240270454          -0.84441791529
                  1.8771488722           0.92646952846
                  0.82033199226          0.53091094490
            S    2   1.00
                 10.341549887           -0.90331119154D-02
                  1.3672524155           0.22980877714
            S    1   1.00
                  0.18314843823          1.0000000
            S    1   1.00
                  0.69547226146D-01      1.0000000
            S    1   1.00
                  0.34867474697D-01      1.0000000
            P    4   1.00
                 21.293597748            0.37103218279D-01
                  8.8171842499          -0.32351709661
                  1.2347028371           0.83846760898
                  0.57869142617          0.23294977050
            P    1   1.00
                  2.5084050284           1.0000000
            P    1   1.00
                  0.21298577719          1.0000000
            P    1   1.00
                  0.67364584657D-01      1.0000000
            D    5   1.00
                 39.693023177            0.39185734275D-02
                 20.852179275           -0.68210073667D-02
                  3.6907832774           0.27938420495
                  1.5849404530           0.52607409874
                  0.62772693365          0.36149465348
            D    1   1.00
                  0.20500000000          1.0000000
            D    1   1.00
                  0.54356625231D-01      1.0000000
            ****
            -Sb     0
            S    6   1.00
                372.76139166             0.15878057239D-02
                 22.689478596           -0.15027605583
                 18.391547037            0.35915813039
                  7.6406271414          -0.74805091065
                  1.9052000235           0.92017581656
                  0.93007107773          0.46754079597
            S    2   1.00
                 10.584496987           -0.14845336778D-01
                  1.4680242769           0.35289492025
            S    1   1.00
                  0.21621190032          1.0000000
            S    1   1.00
                  0.83546307041D-01      1.0000000
            S    1   1.00
                  0.43729879440D-01      1.0000000
            P    4   1.00
                 15.926550950            0.13206950012
                 10.052739237           -0.41511149340
                  1.2682183726           0.74197972626
                  0.57196620929          0.15580772750
            P    1   1.00
                  2.6190751238           1.0000000
            P    1   1.00
                  0.25183282652          1.0000000
            P    1   1.00
                  0.83389127684D-01      1.0000000
            D    5   1.00
                 45.485063360            0.32556415807D-02
                 18.504059617           -0.54952972010D-02
                  3.9156032308           0.27988806353
                  1.7142196009           0.51273377761
                  0.69675478242          0.33288802736
            D    1   1.00
                  0.23060000000          1.0000000
            D    1   1.00
                  0.66830850850D-01      1.0000000
            ****
            -Te     0
            S    6   1.00
                396.47954659             0.26307731203D-02
                 21.919773309           -0.13203517066
                 18.061271390            0.36203197834
                  8.1403463241          -0.75591120276
                  2.0705998798           0.79192928400
                  0.97715185085          0.40558342540
            S    2   1.00
                 11.263563841           -0.15212984183D-01
                  1.6122696062           0.35202140517
            S    1   1.00
                  0.25095401705          1.0000000
            S    1   1.00
                  0.97478452576D-01      1.0000000
            S    1   1.00
                  0.38352170654D-01      1.0000000
            P    4   1.00
                 17.479502221            0.11517799182
                 10.433943171           -0.41205302672
                  1.3623024763           0.78760578076
                  0.59239616258          0.15283299018
            P    1   1.00
                  2.7961737670           1.0000000
            P    1   1.00
                  0.29766401026          1.0000000
            P    1   1.00
                  0.96151090240D-01      1.0000000
            P    1   1.00
                  0.26339831052D-01      1.0000000
            D    5   1.00
                 50.821835991            0.33763474774D-02
                 18.884095378           -0.35221408938D-02
                  4.2527304630           0.28254216065
                  1.8757557092           0.52039372916
                  0.77069282849          0.32213541689
            D    1   1.00
                  0.25000000000          1.0000000
            D    1   1.00
                  0.66543837442D-01      1.0000000
            ****
            -I     0
            S    6   1.00
                445.90489176             0.20037290389D-02
                 23.336842412           -0.14989397324
                 19.583446104            0.36436474913
                  8.5112089186          -0.75538138199
                  2.1996161861           0.82816359356
                  1.0668970454           0.42161048110
            S    2   1.00
                 11.720547572           -0.16160234511D-01
                  1.7625986449           0.35271525193
            S    1   1.00
                  0.28697476318          1.0000000
            S    1   1.00
                  0.11227609607          1.0000000
            S    1   1.00
                  0.45123635492D-01      1.0000000
            P    4   1.00
                 20.499027254            0.77159335656D-01
                 10.558754576           -0.38370372780
                  1.5015895485           0.83554174719
                  0.64597173095          0.16787259488
            P    1   1.00
                  3.0288656771           1.0000000
            P    1   1.00
                  0.34506591841          1.0000000
            P    1   1.00
                  0.11134513813          1.0000000
            P    1   1.00
                  0.29795507230D-01      1.0000000
            D    5   1.00
                 51.235354920            0.40345130346D-02
                 15.616239482           -0.50768108881D-02
                  4.5266002139           0.29151065356
                  2.0529808766           0.51145783605
                  0.87640281623          0.31232025297
            D    1   1.00
                  0.30900000000          1.0000000
            D    1   1.00
                  0.77987255180D-01      1.0000000
            ****
            -Xe     0
            S    5   1.00
               6420.2481656              0.25092173886D-03
                983.54530664             0.16251948178D-02
                219.43881364             0.46037106451D-02
                 23.012587807           -0.14698707182
                 18.048324490            0.57524870348
            S    2   1.00
                 11.752550163            0.66038420156
                  6.2390917199           0.38470524721
            S    1   1.00
                  2.6257211320           1.0000000
            S    1   1.00
                  1.2905042943           1.0000000
            S    1   1.00
                  0.36204185060          1.0000000
            S    1   1.00
                  0.14069888091          1.0000000
            S    1   1.00
                  0.50201095588D-01      1.0000000
            P    4   1.00
                 13.960683826           -0.50950157807D-01
                  4.0928947097           0.36669211800
                  2.2546815460           0.72619456861
                  1.1546596184           0.35555871740
            P    3   1.00
                193.81432545             0.95394802497D-03
                 21.725228086            0.57393353332D-01
                  9.8891605641          -0.27974266640
            P    1   1.00
                  0.52321923128          1.0000000
            P    1   1.00
                  0.21945569800          1.0000000
            P    1   1.00
                  0.86158996836D-01      1.0000000
            P    1   1.00
                  0.23749464135D-01      1.0000000
            D    6   1.00
                135.60300038             0.81873543290D-03
                 38.727062692            0.60897654151D-02
                 15.377328089           -0.92782985596D-02
                  5.2602537686           0.22890785589
                  2.6590627424           0.44434407051
                  1.2938205124           0.36029482992
            D    1   1.00
                  0.58050830139          1.0000000
            D    1   1.00
                  0.18000000000          1.0000000
            D    1   1.00
                  0.68002755933D-01      1.0000000
            F    1   1.00
                  2.5000000              1.0000000
            F    1   1.00
                  0.49652793             1.0000000
            ****
            -Cs     0
            S    3   1.00
                  5.8778113443           0.12859994983
                  4.3631538286          -0.34632569725
                  1.8048475155           0.69930637051
            S    1   1.00
                  0.37485237136          1.0000000
            S    1   1.00
                  0.16384858778          1.0000000
            S    1   1.00
                  0.27230462048D-01      1.0000000
            S    1   1.00
                  0.11991533212D-01      1.0000000
            P    4   1.00
                  4.2751856154           0.45723074174D-01
                  1.9656663360          -0.25019961976
                  0.47689195212          0.55660850066
                  0.21529749588          0.58218553406
            P    1   1.00
                  0.91450850296D-01      1.0000000
            P    1   1.00
                  0.17592078473D-01      1.0000000
            P    1   1.00
                  0.33986441258D-02      1.0000000
            D    1   1.00
                  0.1330000              1.0000000
            D    1   1.00
                  0.33216214821D-01      1.0000000
            ****
            -Ba     0
            S    3   1.00
                  2.3961900000          -5.9554766710
                  2.2433050000           6.6805648241
                  0.71740200000         -0.57055347037
            S    1   1.00
                  0.27420073547          1.0000000
            S    1   1.00
                  0.40933264188D-01      1.0000000
            S    1   1.00
                  0.18060156423D-01      1.0000000
            P    4   1.00
                  2.9267420000           0.79815276764
                  2.5207180000          -1.0707548832
                  0.67578180854          0.34940781448
                  0.31985844531          0.65041110673
            P    1   1.00
                  0.13221792446          1.0000000
            P    1   1.00
                  0.33039565349D-01      1.0000000
            P    1   1.00
                  0.14159090510D-01      1.0000000
            D    4   1.00
                  0.9663150             -0.9089380
                  0.8938280              0.9472400
                  0.2731950              0.3220570
                  0.1038910              0.4732600
            D    1   1.00
                  0.0355780              0.365977
            F    4   1.00
                 10.00                   0.073
                  3.20                   0.210
                  1.00                   0.350
                  0.32                   0.360
            ****
            -La     0
            S    2   1.00
                  5.0873990000          -0.44173707857
                  4.2709780000           0.85812489720
            S    1   1.00
                  2.1823803999           1.0000000
            S    1   1.00
                  0.48954926461          1.0000000
            S    1   1.00
                  0.23292032550          1.0000000
            S    1   1.00
                  0.55595529876D-01      1.0000000
            S    1   1.00
                  0.22795184937D-01      1.0000000
            P    4   1.00
                  3.0251610000          -0.28580266654872D+00
                  2.3820950000           0.51718364643673D+00
                  0.67246658081         -0.44823115995325D+00
                  0.32519427171         -0.58864843929619D+00
            P    1   1.00
                  0.13635489374          1.0000000
            P    1   1.00
                  0.58500000000D-01      1.0000000
            P    1   1.00
                  0.0251000              1.0000000
            D    4   1.00
                  1.2667182018          -0.17445579381106D+00
                  0.89049882672          0.25137236211233D+00
                  0.32947291040          0.44604068239531D+00
                  0.13398788830          0.44878277154181D+00
            D    1   1.00
                  0.51275503081D-01      1.0000000
            F    1   1.00
                  0.2568300              1.0000000
            ****
            -Hf     0
            S    2   1.00
                 14.592485000           -0.80196298812
                 11.547491000            1.5261602829
            S    1   1.00
                  4.9112973928           1.0000000
            S    1   1.00
                  0.79665469409          1.0000000
            S    1   1.00
                  0.34234072894          1.0000000
            S    1   1.00
                  0.98109197714D-01      1.0000000
            S    1   1.00
                  0.36190984443D-01      1.0000000
            P    4   1.00
                  6.7265310000           0.65076205465872
                  5.9599790000          -0.83713508620273
                  1.0921117054           0.50570506286223
                  0.49702823217          0.51965388690539
            P    1   1.00
                  0.20258973792          1.0000000
            P    1   1.00
                  0.82500000000D-01      1.0000000
            P    1   1.00
                  0.0336000              1.0000000
            D    4   1.00
                  3.9820623229          -0.042446023944105
                  1.3077987772           0.18409232564002
                  0.53272310298          0.41484423515705
                  0.20564954488          0.44224303496859
            D    1   1.00
                  0.73099858787D-01      1.0000000
            F    1   1.00
                  0.3154700              1.0000000
            ****
            -Ta     0
            S    2   1.00
                 14.400000000            0.99343296745
                 12.000000000           -1.6510077975
            S    1   1.00
                  5.0701477302           1.0000000
            S    1   1.00
                  0.86033356487          1.0000000
            S    1   1.00
                  0.37158938894          1.0000000
            S    1   1.00
                  0.10745336254          1.0000000
            S    1   1.00
                  0.39142776556D-01      1.0000000
            P    4   1.00
                  7.4188720000           0.26979695152
                  5.6984100000          -0.46968874449
                  1.1777211960           0.50905100155
                  0.54478533555          0.52298161137
            P    1   1.00
                  0.22309270117          1.0000000
            P    1   1.00
                  0.98100000000D-01      1.0000000
            P    1   1.00
                  0.0431000              1.0000000
            D    4   1.00
                  3.9738796278          -0.52799310714D-01
                  1.4528884813           0.18558319471
                  0.61042908544          0.42959071631
                  0.24216276510          0.43497228231503D+00
            D    1   1.00
                  0.87909318337D-01      1.0000000
            F    1   1.00
                  0.3738600              1.0000000
            ****
            -W     0
            S    2   1.00
                 15.000000000           -0.53315505392
                 12.000000000            1.0014141748
            S    1   1.00
                  5.2610967725           1.0000000
            S    1   1.00
                  0.92785370307          1.0000000
            S    1   1.00
                  0.40334458241          1.0000000
            S    1   1.00
                  0.11585976646          1.0000000
            S    1   1.00
                  0.41800474073D-01      1.0000000
            P    4   1.00
                  7.2496570000           0.45857265530
                  6.0848760000          -0.66720686321
                  1.2523777812           0.52090351989
                  0.58569208922          0.51885687511
            P    1   1.00
                  0.24106964301          1.0000000
            P    1   1.00
                  0.98600000000D-01      1.0000000
            P    1   1.00
                  0.0403000              1.0000000
            D    4   1.00
                  4.0131231332          -0.63416491808D-01
                  1.6237452450           0.18452733732
                  0.69187452392          0.44121676843
                  0.27865835325          0.43158409241461D+00
            D    1   1.00
                  0.10225296446          1.0000000
            F    1   1.00
                  0.4319900              1.0000000
            ****
            -Re     0
            S    2   1.00
                 14.781862000           -1.1395193885
                 12.324075000            1.9371421121
            S    1   1.00
                  5.5098597284           1.0000000
            S    1   1.00
                  0.98874104687          1.0000000
            S    1   1.00
                  0.42833312030          1.0000000
            S    1   1.00
                  0.12296804533          1.0000000
            S    1   1.00
                  0.43949851581D-01      1.0000000
            P    4   1.00
                  7.4040050000           0.54510937865
                  6.3502060000          -0.76096056536
                  1.3311713455           0.53252276765
                  0.62659600547          0.51483045040
            P    1   1.00
                  0.25922718696          1.0000000
            P    1   1.00
                  0.11190000000          1.0000000
            P    1   1.00
                  0.04200000000          1.0000000
            D    4   1.00
                  4.0616274916          -0.76667295205D-01
                  1.8487943286           0.18067495215
                  0.78702048429          0.45160766937
                  0.32069843172          0.43261236265745D+00
            D    1   1.00
                  0.11892742980          1.0000000
            F    1   1.00
                  0.4898900              1.0000000
            ****
            -Os     0
            S    2   1.00
                 15.286736000           -1.0647114485
                 12.700638000            1.8433193269
            S    1   1.00
                  5.7094832504           1.0000000
            S    1   1.00
                  1.0689228744           1.0000000
            S    1   1.00
                  0.46783543749          1.0000000
            S    1   1.00
                  0.13253456992          1.0000000
            S    1   1.00
                  0.47101982911D-01      1.0000000
            P    4   1.00
                  7.9362790000           0.33899369659
                  6.3036410000          -0.56379438345
                  1.4351579676           0.52360040577
                  0.68442749722          0.52445339821
            P    1   1.00
                  0.28347394974          1.0000000
            P    1   1.00
                  0.12830000000          1.0000000
            P    1   1.00
                  0.04800000000          1.0000000
            D    4   1.00
                  3.5808150000          -0.42773932262
                  3.1961650000           0.44501403992
                  1.0550226354           0.43689459722
                  0.41588406618          0.48220605798770D+00
            D    1   1.00
                  0.14653507868          1.0000000
            F    1   1.00
                  0.5506500              1.0000000
            ****
            -Ir     0
            S    2   1.00
                 15.293709000           -1.6731899791
                 13.573682000            2.3934378976
            S    1   1.00
                  5.8213436542           1.0000000
            S    1   1.00
                  1.1520364268           1.0000000
            S    1   1.00
                  0.51104895338          1.0000000
            S    1   1.00
                  0.14084043578          1.0000000
            S    1   1.00
                  0.49828673085D-01      1.0000000
            P    4   1.00
                  8.6697960000           0.21469187346391
                  6.2456140000          -0.44863071815131
                  1.5657036153           0.50653393256771
                  0.75577412863          0.54052273352337
            P    1   1.00
                  0.31306011113          1.0000000
            P    1   1.00
                  0.13100000000          1.0000000
            P    1   1.00
                  0.0548000              1.0000000
            D    4   1.00
                  3.6994850000          -0.54840155964653
                  3.3617430000           0.56835425804006
                  1.1177053710           0.44304381513032
                  0.44322534858          0.47078394930144
            D    1   1.00
                  0.15641305125          1.0000000
            F    1   1.00
                  0.6100800              1.0000000
            ****
            -Pt     0
            S    2   1.00
                 16.559563000           -0.53808800717
                 13.892440000            0.91402161377
            S    1   1.00
                  5.8531044732           1.0000000
            S    1   1.00
                  1.2498640609           1.0000000
            S    1   1.00
                  0.55606439459          1.0000000
            S    1   1.00
                  0.13793093812          1.0000000
            S    1   1.00
                  0.48989034059D-01      1.0000000
            P    4   1.00
                  8.1000000000           0.72955608128
                  7.2000000000          -0.95441807252
                  1.5588402917           0.57140490320
                  0.73230402180          0.49508234268
            P    1   1.00
                  0.30270484669          1.0000000
            P    1   1.00
                  0.12300000000          1.0000000
            P    1   1.00
                  0.50000000000D-01      1.0000000
            D    4   1.00
                  4.6299536825          -0.87774450596D-01
                  2.1980241252           0.21158360681
                  0.93629991261          0.46533857641
                  0.37160028160          0.41129165525
            D    1   1.00
                  0.13155928617          1.0000000
            F    1   1.00
                  0.6681300              1.0000000
            ****
            -Au     0
            S    2   1.00
                 20.115299000           -0.15910719389
                 12.193477000            0.79105526778
            S    1   1.00
                  6.0735294368           1.0000000
            S    1   1.00
                  1.3174451569           1.0000000
            S    1   1.00
                  0.58596768244          1.0000000
            S    1   1.00
                  0.13875427354          1.0000000
            S    1   1.00
                  0.48876985527D-01      1.0000000
            P    4   1.00
                  8.6096650000           0.50053018599
                  7.3353260000          -0.72681584494
                  1.6575296365           0.57315511417
                  0.78159310216          0.49579068859
            P    1   1.00
                  0.32384840661          1.0000000
            P    1   1.00
                  0.13220000000          1.0000000
            P    1   1.00
                  0.0540000              1.0000000
            D    4   1.00
                  4.1439490000          -0.37099566643
                  3.5682570000           0.40197233762
                  1.2345757130           0.46001988624
                  0.48190232338          0.46152130957882D+00
            D    1   1.00
                  0.16490636769          1.0000000
            F    1   1.00
                  0.7248200              1.0000000
            ****
            -Hg     0
            S    2   1.00
                 26.842049000           -0.26845096483D-01
                 10.320909000            0.81771278143
            S    1   1.00
                  6.3656242291           1.0000000
            S    1   1.00
                  1.3898932095           1.0000000
            S    1   1.00
                  0.63706742699          1.0000000
            S    1   1.00
                  0.16047725098          1.0000000
            S    1   1.00
                  0.56410423453D-01      1.0000000
            P    4   1.00
                  9.7729900000           0.21210940502
                  7.1690950000          -0.44026342153
                  1.7559567931           0.58406314464
                  0.83145670425          0.49359746203
            P    1   1.00
                  0.34494917659          1.0000000
            P    1   1.00
                  0.15540000000          1.0000000
            P    1   1.00
                  0.07000000000          1.0000000
            D    4   1.00
                  4.2800000000          -0.32033414305491
                  3.4800000000           0.37748470203231
                  1.2535869926           0.48342275878173
                  0.50841366863          0.43493523158359
            D    1   1.00
                  0.18501599388          1.0000000
            F    1   1.00
                  0.7956900              1.0000000
            ****
            -Tl     0
            S    6   1.00
                 45.356924655            0.50938157397D-02
                 20.278843336           -0.14805704314
                 14.420612394            0.36768453564
                  6.2161909754          -0.66820394623
                  1.5002511178           0.96232806743
                  0.76330879305          0.33175999361
            S    2   1.00
                  7.8193195283          -0.18828631537D-01
                  1.3176904042           0.32093431467
            S    1   1.00
                  0.17643545481          1.0000000
            S    1   1.00
                  0.65296835238D-01      1.0000000
            S    1   1.00
                  0.24592841139D-01      1.0000000
            P    4   1.00
                  9.0323058024           0.22738839085
                  7.5356419671          -0.35117975889
                  1.0521421998           0.25690085604
                  0.50303932656          0.84549942764D-01
            P    1   1.00
                  2.0067660913           1.0000000
            P    1   1.00
                  0.16675605056          1.0000000
            P    1   1.00
                  0.48596401464D-01      1.0000000
            D    5   1.00
                  9.4421940760           0.58250776986D-01
                  7.4410003381          -0.11789199301
                  1.9831617772           0.34232057636
                  0.91671748567          0.47557282350
                  0.39647207885          0.30528029435
            D    1   1.00
                  0.15500000000          1.0000000
            D    1   1.00
                  0.39237960293D-01      1.0000000
            ****
            -Pb     0
            S    6   1.00
                 55.727520333            0.29681153058D-02
                 20.302912827           -0.14352634362
                 14.558628750            0.37554188507
                  6.5370530973          -0.67253099800
                  1.5933900686           0.95887533909
                  0.83051419711          0.32593632538
            S    2   1.00
                  8.0719473648          -0.20412061217D-01
                  1.4165737490           0.32865829049
            S    1   1.00
                  0.20418933370          1.0000000
            S    1   1.00
                  0.77159007761D-01      1.0000000
            S    1   1.00
                  0.33059793391D-01      1.0000000
            P    4   1.00
                  9.5531412199           0.20542943990
                  7.5327685129          -0.36407590058
                  1.1185539567           0.32217481686
                  0.53739855255          0.96677743015D-01
            P    1   1.00
                  2.1359869828           1.0000000
            P    1   1.00
                  0.20027494801          1.0000000
            P    1   1.00
                  0.63408011513D-01      1.0000000
            D    5   1.00
                 13.494505735            0.11571042371D-01
                  7.0609770411          -0.66746645076D-01
                  2.1581835375           0.33978760942
                  1.0148541418           0.48523039273
                  0.44632672920          0.29682924018
            D    1   1.00
                  0.17500000000          1.0000000
            D    1   1.00
                  0.50585085346D-01      1.0000000
            ****
            -Bi     0
            S    6   1.00
                175.19632102             0.80278879028D-03
                 19.820147783           -0.14624461250
                 14.960110102            0.37435719885
                  6.7065785571          -0.68476017748
                  1.7391967524           0.90967322081
                  0.94504730591          0.38695797807
            S    2   1.00
                  8.4636832909          -0.20037183144D-01
                  1.5317838545           0.31054408682
            S    1   1.00
                  0.23405391503          1.0000000
            S    1   1.00
                  0.90268814613D-01      1.0000000
            S    1   1.00
                  0.41577775054D-01      1.0000000
            P    4   1.00
                 10.672046293            0.14391258793
                  7.1992185915          -0.37994608603
                  1.5359697528           0.53268032065
                  0.72201275727          0.23037698678
            P    1   1.00
                  2.8508661858           1.0000000
            P    1   1.00
                  0.23769418731          1.0000000
            P    1   1.00
                  0.78768140453D-01      1.0000000
            D    5   1.00
                 15.834273510            0.85062993231D-02
                  7.0956896087          -0.65954380016D-01
                  2.3363137007           0.33707163406
                  1.1208861366           0.49128719933
                  0.50309487376          0.29095930644
            D    1   1.00
                  0.20000000000          1.0000000
            D    1   1.00
                  0.62256480090D-01      1.0000000
            ****
            -Po     0
            S    6   1.00
                278.13783916             0.91690497839D-03
                 19.659291105           -0.14713009283
                 15.016229647            0.38790413631
                  7.1149978720          -0.67059966298
                  1.7879214122           0.91212928327
                  0.94021655206          0.29153755200
            S    2   1.00
                  8.7584161749          -0.21561417525D-01
                  1.6503945866           0.31638990001
            S    1   1.00
                  0.26329582133          1.0000000
            S    1   1.00
                  0.10190654304          1.0000000
            S    1   1.00
                  0.36854928339D-01      1.0000000
            P    4   1.00
                 10.445945973            0.23631841405
                  8.0293101888          -0.45017818996
                  1.3588798023           0.44160334658
                  0.66829182929          0.14575285544
            P    1   1.00
                  2.4460635387           1.0000000
            P    1   1.00
                  0.27242942777          1.0000000
            P    1   1.00
                  0.88796031338D-01      1.0000000
            P    1   1.00
                  0.24278917089D-01      1.0000000
            D    5   1.00
                 18.292670150            0.72030963652D-02
                  7.1695578539          -0.66160544754D-01
                  2.5029225180           0.34363449378
                  1.2115945443           0.50529101033
                  0.54713334240          0.28301155453
            D    1   1.00
                  0.21500000000          1.0000000
            D    1   1.00
                  0.60680939679D-01      1.0000000
            ****
            -At     0
            S    6   1.00
                303.23376176             0.63504969788D-03
                 20.289449240           -0.13823165350
                 15.383783126            0.38333193283
                  7.4702184232          -0.66837560338
                  1.8731608346           0.91545877992
                  0.97426847543          0.25559567998
            S    2   1.00
                  8.9610112498          -0.23092977605D-01
                  1.7804284294           0.31690635939
            S    1   1.00
                  0.29269461143          1.0000000
            S    1   1.00
                  0.11395353119          1.0000000
            S    1   1.00
                  0.42558321816D-01      1.0000000
            P    4   1.00
                 10.722023134            0.26194870008
                  8.4823338656          -0.46607228264
                  1.3474291294           0.42119853309
                  0.62824011467          0.10643224457
            P    1   1.00
                  2.4814896839           1.0000000
            P    1   1.00
                  0.31036518470          1.0000000
            P    1   1.00
                  0.10144862043          1.0000000
            P    1   1.00
                  0.26996558228D-01      1.0000000
            D    5   1.00
                 20.799819604            0.65227965381D-02
                  7.1664616770          -0.67780885217D-01
                  2.6934397048           0.33954991335
                  1.3175112423           0.50899559178
                  0.59997066293          0.27526771759
            D    1   1.00
                  0.23500000000          1.0000000
            D    1   1.00
                  0.67929272623D-01      1.0000000
            ****
            -Rn     0
            S    5   1.00
               5187.7442468              0.16097034848D-03
                768.14491207             0.10508214789D-02
                159.35182065             0.27375438093D-02
                 21.863432724           -0.55045904905
                 18.388689978            0.78321373922
            S    2   1.00
                 24.816226448           -0.82636797204D-01
                  7.2923301677           1.0926256000
            S    1   1.00
                  2.0850437166           1.0000000
            S    1   1.00
                  1.0915245945           1.0000000
            S    1   1.00
                  0.34915708428          1.0000000
            S    1   1.00
                  0.13648422952          1.0000000
            S    1   1.00
                  0.46837581728D-01      1.0000000
            P    4   1.00
                  9.0845000304          -0.23093917426
                  6.2631489717           0.39747614192
                  2.2545193734           0.83026693838
                  1.1180666918           0.51467013112
            P    3   1.00
                194.68918723             0.26265814046D-03
                 11.210013525            0.19952302621
                  7.5298316489          -0.45994479561
            P    1   1.00
                  0.47444492594          1.0000000
            P    1   1.00
                  0.20172354616          1.0000000
            P    1   1.00
                  0.79503144392D-01      1.0000000
            P    1   1.00
                  0.22264519316D-01      1.0000000
            D    6   1.00
                 75.302723665            0.73590238429D-03
                 17.965913830            0.89490827389D-02
                  7.3741298033          -0.76641663693D-01
                  3.2296258578           0.22975404602
                  1.7937840508           0.43991495311
                  0.94633319732          0.35259395198
            D    1   1.00
                  0.46860482223          1.0000000
            D    1   1.00
                  0.20000000000          1.0000000
            D    1   1.00
                  0.68815941916D-01      1.0000000
            F    1   1.00
                  2.1000000              1.0000000
            F    1   1.00
                  0.4180600              1.0000000
            ****
            
            -RB     0
            RB-ECP     3     28
            f potential
              1
            2      3.8431140            -12.3169000
            s-f potential
              3
            2      5.0365510             89.5001980
            2      1.9708490              0.4937610
            2      3.8431140             12.3169000
            p-f potential
              3
            2      4.2583410             58.5689740
            2      1.4707090              0.4317910
            2      3.8431140             12.3169000
            d-f potential
              3
            2      3.0231270             26.2248980
            2      0.6503830              0.9628390
            2      3.8431140             12.3169000
            -SR     0
            SR-ECP     3     28
            f potential
              1
            2      4.6339750            -15.8059920
            s-f potential
              3
            2      7.4000740            135.4794300
            2      3.6063790             17.5344630
            2      4.6339750             15.8059920
            p-f potential
              3
            2      6.4848680             88.3597090
            2      3.2880530             15.3943720
            2      4.6339750             15.8059920
            d-f potential
              3
            2      4.6228410             29.8889870
            2      2.2469040              6.6594140
            2      4.6339750             15.8059920
            -Y     0
            Y-ECP     3     28
            f potential
              2
            2      6.5842120            -19.12219811
            2      3.2921060             -2.43637543
            s-f potential
              4
            2      7.4880494            135.15384412
            2      3.7440247             15.55244130
            2      6.5842120             19.12219811
            2      3.2921060              2.43637543
            p-f potential
              4
            2      6.4453772             87.78499167
            2      3.2226886             11.56406599
            2      6.5842120             19.12219811
            2      3.2921060              2.43637543
            d-f potential
              4
            2      4.6584472             29.70100072
            2      2.3292236              5.53996847
            2      6.5842120             19.12219811
            2      3.2921060              2.43637543
            -ZR     0
            ZR-ECP     3     28
            f potential
              2
            2      7.5400000            -21.09377605
            2      3.7700000             -3.08069427
            s-f potential
              4
            2      8.2000000            150.26759106
            2      4.0897278             18.97621650
            2      7.5400000             21.09377605
            2      3.7700000              3.08069427
            p-f potential
              4
            2      7.1100000             99.62212372
            2      3.5967980             14.16873329
            2      7.5400000             21.09377605
            2      3.7700000              3.08069427
            d-f potential
              4
            2      5.3500000             35.04512355
            2      2.4918215              6.11125948
            2      7.5400000             21.09377605
            2      3.7700000              3.08069427
            -NB     0
            NB-ECP     3     28
            f potential
              2
            2      8.4900000            -22.92954996
            2      4.2500000             -3.66630986
            s-f potential
              4
            2      8.9000000            165.17914349
            2      4.4300000             21.99297437
            2      8.4900000             22.92954996
            2      4.2500000              3.66630986
            p-f potential
              4
            2      7.7700000            111.79441445
            2      3.9600000             16.63348326
            2      8.4900000             22.92954996
            2      4.2500000              3.66630986
            d-f potential
              4
            2      6.0500000             38.11224880
            2      2.8400000              8.03916727
            2      8.4900000             22.92954996
            2      4.2500000              3.66630986
            -MO     0
            MO-ECP     3     28
            f potential
              2
            2      9.4500000            -24.80517707
            2      4.7200000             -4.15378155
            s-f potential
              4
            2      9.7145938            180.10310850
            2      4.6805004             24.99722791
            2      9.4500000             24.80517707
            2      4.7200000              4.15378155
            p-f potential
              4
            2      8.1421366            123.77275231
            2      4.6259863             19.53022800
            2      9.4500000             24.80517707
            2      4.7200000              4.15378155
            d-f potential
              4
            2      6.6184148             48.37502229
            2      3.2487516              8.89205274
            2      9.4500000             24.80517707
            2      4.7200000              4.15378155
            -TC     0
            TC-ECP     3     28
            f potential
              2
            2     10.4000000            -26.56244747
            2      5.2000000             -4.58568054
            s-f potential
              4
            2     10.4223462            195.15916591
            2      5.0365160             28.09260333
            2     10.4000000             26.56244747
            2      5.2000000              4.58568054
            p-f potential
              4
            2      8.9504494            135.28456622
            2      4.8544394             21.80650430
            2     10.4000000             26.56244747
            2      5.2000000              4.58568054
            d-f potential
              4
            2      6.9456968             54.32972942
            2      3.9705849             11.15506795
            2     10.4000000             26.56244747
            2      5.2000000              4.58568054
            -RU     0
            RU-ECP     3     28
            f potential
              2
            2     11.3600000            -28.34061627
            2      5.6800000             -4.94462923
            s-f potential
              4
            2     11.1052693            209.82297122
            2      5.4147454             30.65472642
            2     11.3600000             28.34061627
            2      5.6800000              4.94462923
            p-f potential
              4
            2      9.7712707            146.33618228
            2      5.0739908             24.12787723
            2     11.3600000             28.34061627
            2      5.6800000              4.94462923
            d-f potential
              4
            2      7.6714231             67.51589667
            2      4.1365647              9.87010415
            2     11.3600000             28.34061627
            2      5.6800000              4.94462923
            -RH     0
            RH-ECP     3     28
            f potential
              2
            2     12.3100000            -30.09345572
            2      6.1600000             -5.21848192
            s-f potential
              4
            2     11.7200000            225.34775353
            2      5.8200000             32.82318898
            2     12.3100000             30.09345572
            2      6.1600000              5.21848192
            p-f potential
              4
            2     10.4200000            158.70941159
            2      5.4500000             26.44410049
            2     12.3100000             30.09345572
            2      6.1600000              5.21848192
            d-f potential
              4
            2      8.8200000             62.75862572
            2      3.8700000             10.97871947
            2     12.3100000             30.09345572
            2      6.1600000              5.21848192
            -PD     0
            PD-ECP     3     28
            f potential
              2
            2     13.2700000            -31.92955431
            2      6.6300000             -5.39821694
            s-f potential
              4
            2     12.4300000            240.22904033
            2      6.1707594             35.17194347
            2     13.2700000             31.92955431
            2      6.6300000              5.39821694
            p-f potential
              4
            2     11.0800000            170.41727605
            2      5.8295541             28.47213287
            2     13.2700000             31.92955431
            2      6.6300000              5.39821694
            d-f potential
              4
            2      9.5100000             69.01384488
            2      4.1397811             11.75086158
            2     13.2700000             31.92955431
            2      6.6300000              5.39821694
            -AG     0
            AG-ECP     3     28
            f potential
              2
            2     14.2200000            -33.68992012
            2      7.1100000             -5.53112021
            s-f potential
              4
            2     13.1300000            255.13936452
            2      6.5100000             36.86612154
            2     14.2200000             33.68992012
            2      7.1100000              5.53112021
            p-f potential
              4
            2     11.7400000            182.18186871
            2      6.2000000             30.35775148
            2     14.2200000             33.68992012
            2      7.1100000              5.53112021
            d-f potential
              4
            2     10.2100000             73.71926087
            2      4.3800000             12.50211712
            2     14.2200000             33.68992012
            2      7.1100000              5.53112021
            -CD     0
            CD-ECP     3     28
            f potential
              2
            2     15.1847957            -35.47662555
            2      7.5923978             -5.61767685
            s-f potential
              4
            2     13.8358689            270.00948324
            2      6.8572704             38.76730798
            2     15.1847957             35.47662555
            2      7.5923978              5.61767685
            p-f potential
              4
            2     12.4049710            193.82962939
            2      6.5677995             31.89652523
            2     15.1847957             35.47662555
            2      7.5923978              5.61767685
            d-f potential
              4
            2     10.8969253             79.19364700
            2      4.6411649             13.23082674
            2     15.1847957             35.47662555
            2      7.5923978              5.61767685
            -IN     0
            IN-ECP     3     28
            f potential
              2
            2     12.53905600           -13.72807800
            2     12.55256100           -18.20686600
            s-f potential
              4
            2     15.39282200           281.12235000
            2      8.05586400            61.90147000
            2     12.53905600            13.72807800
            2     12.55256100            18.20686600
            p-f potential
              6
            2     13.92867200            67.46215400
            2     13.34723400           134.94925000
            2      7.61413200            14.74614000
            2      7.31836500            29.63926200
            2     12.53905600            13.72807800
            2     12.55256100            18.20686600
            d-f potential
              6
            2     14.03471500            35.49325400
            2     14.51161600            53.17877300
            2      5.55055000             9.17728100
            2      5.05941500            12.39241000
            2     12.53905600            13.72807800
            2     12.55256100            18.20686600
            -SN     0
            SN-ECP     3     28
            f potential
              2
            2     12.28234800           -12.57633300
            2     12.27215000           -16.59594400
            s-f potential
              4
            2     17.42041400           279.98868200
            2      7.63115500            62.37781000
            2     12.28234800            12.57633300
            2     12.27215000            16.59594400
            p-f potential
              6
            2     16.13102400            66.16252300
            2     15.62807700           132.17439600
            2      7.32560800            16.33941700
            2      6.94251900            32.48895900
            2     12.28234800            12.57633300
            2     12.27215000            16.59594400
            d-f potential
              6
            2     15.51497600            36.38744100
            2     15.18816000            54.50784100
            2      5.45602400             8.69682300
            2      5.36310500            12.84020800
            2     12.28234800            12.57633300
            2     12.27215000            16.59594400
            -SB     0
            SB-ECP     3     28
            f potential
              2
            2     14.44497800           -15.36680100
            2     14.44929500           -20.29613800
            s-f potential
              4
            2     16.33086500           281.07158100
            2      8.55654200            61.71660400
            2     14.44497800            15.36680100
            2     14.44929500            20.29613800
            p-f potential
              6
            2     14.47033700            67.45738000
            2     13.81619400           134.93350300
            2      8.42492400            14.71634400
            2      8.09272800            29.51851200
            2     14.44497800            15.36680100
            2     14.44929500            20.29613800
            d-f potential
              6
            2     14.88633100            35.44781500
            2     15.14631900            53.14346600
            2      5.90826700             9.17922300
            2      5.59432200            13.24025300
            2     14.44497800            15.36680100
            2     14.44929500            20.29613800
            -TE     0
            TE-ECP     3     28
            f potential
              2
            2     15.20616800           -15.74545000
            2     15.20170200           -20.74244800
            s-f potential
              4
            2     16.81447300           281.04584300
            2      8.79352600            61.62065600
            2     15.20616800            15.74545000
            2     15.20170200            20.74244800
            p-f potential
              6
            2     14.87780100            67.44946400
            2     14.26973100           134.90430400
            2      8.72443500            14.68954700
            2      8.29151500            29.41506300
            2     15.20616800            15.74545000
            2     15.20170200            20.74244800
            d-f potential
              6
            2     15.20500800            35.43205700
            2     15.22584800            53.13568700
            2      6.07176900             9.06980200
            2      5.80476000            13.12230400
            2     15.20616800            15.74545000
            2     15.20170200            20.74244800
            -I     0
            I-ECP     3     28
            f potential
              4
            2     19.45860900           -21.84204000
            2     19.34926000           -28.46819100
            2      4.82376700            -0.24371300
            2      4.88431500            -0.32080400
            s-f potential
              7
            2     40.01583500            49.99429300
            2     17.42974700           281.02531700
            2      9.00548400            61.57332600
            2     19.45860900            21.84204000
            2     19.34926000            28.46819100
            2      4.82376700             0.24371300
            2      4.88431500             0.32080400
            p-f potential
              8
            2     15.35546600            67.44284100
            2     14.97183300           134.88113700
            2      8.96016400            14.67505100
            2      8.25909600            29.37566600
            2     19.45860900            21.84204000
            2     19.34926000            28.46819100
            2      4.82376700             0.24371300
            2      4.88431500             0.32080400
            d-f potential
              10
            2     15.06890800            35.43952900
            2     14.55532200            53.17605700
            2      6.71864700             9.06719500
            2      6.45639300            13.20693700
            2      1.19177900             0.08933500
            2      1.29115700             0.05238000
            2     19.45860900            21.84204000
            2     19.34926000            28.46819100
            2      4.82376700             0.24371300
            2      4.88431500             0.32080400
            -XE     0
            XE-ECP     3     28
            f potential
              4
            2     20.88155700           -23.08929500
            2     20.78344300           -30.07447500
            2      5.25338900            -0.28822700
            2      5.36118800            -0.38692400
            s-f potential
              7
            2     40.00518400            49.99796200
            2     17.81221400           281.01330300
            2      9.30415000            61.53825500
            2     20.88155700            23.08929500
            2     20.78344300            30.07447500
            2      5.25338900             0.28822700
            2      5.36118800             0.38692400
            p-f potential
              8
            2     15.70177200            67.43914200
            2     15.25860800           134.87471100
            2      9.29218400            14.66330000
            2      8.55900300            29.35473000
            2     20.88155700            23.08929500
            2     20.78344300            30.07447500
            2      5.25338900             0.28822700
            2      5.36118800             0.38692400
            d-f potential
              10
            2     15.18560000            35.43690800
            2     14.28450000            53.19577200
            2      7.12188900             9.04623200
            2      6.99196300            13.22368100
            2      0.62394600             0.08485300
            2      0.64728400             0.04415500
            2     20.88155700            23.08929500
            2     20.78344300            30.07447500
            2      5.25338900             0.28822700
            2      5.36118800             0.38692400
            -CS     0
            CS-ECP     3     46
            f potential
              1
            2      3.1232690            -28.8843090
            s-f potential
              3
            2      4.0797500             84.5477300
            2      2.4174060             16.6541730
            2      3.1232690             28.8843090
            p-f potential
              3
            2      5.5140800            157.0490590
            2      2.1603160             26.4233070
            2      3.1232690             28.8843090
            d-f potential
              3
            2      1.8074100             13.1727530
            2      0.8581820              3.3428330
            2      3.1232690             28.8843090
            -BA     0
            BA-ECP     3     46
            f potential
              1
            2      3.5894650            -33.4731740
            s-f potential
              3
            2      9.5269860            427.8458160
            2      4.4875100            204.4175300
            2      3.5894650             33.4731740
            p-f potential
              3
            2      8.3159300            293.6058640
            2      4.2922170            294.1933160
            2      3.5894650             33.4731740
            d-f potential
              3
            2      5.9161080            112.5504020
            2      2.8748420            181.7826210
            2      3.5894650             33.4731740
            -LA     0
            LA-ECP     3     46
            f potential
              1
            2      4.0286000            -36.0100160
            s-f potential
              3
            2      3.3099000             91.9321770
            2      1.6550000             -3.7887640
            2      4.0286000             36.0100160
            p-f potential
              3
            2      2.8368000             63.7594860
            2      1.4184000             -0.6479580
            2      4.0286000             36.0100160
            d-f potential
              3
            2      2.0213000             36.1161730
            2      1.0107000              0.2191140
            2      4.0286000             36.0100160
            -HF     0
            HF-ECP     3     60
            f potential
              1
            2      1.78576984            10.04672251
            s-f potential
              3
            2     14.76995900          1499.28471073
            2      7.38497940            40.28210136
            2      1.78576984           -10.04672251
            p-f potential
              3
            2      9.84948950           397.73300533
            2      4.92474450            19.31640586
            2      1.78576984           -10.04672251
            d-f potential
              3
            2      6.09675640           101.32980526
            2      3.04837820             5.87343821
            2      1.78576984           -10.04672251
            -TA     0
            TA-ECP     3     60
            f potential
              1
            2      2.01788111            12.01796094
            s-f potential
              3
            2     14.54640770          1345.88064703
            2      7.27320380            36.76680620
            2      2.01788111           -12.01796094
            p-f potential
              3
            2      9.93556529           378.42530145
            2      4.96778243            22.29309086
            2      2.01788111           -12.01796094
            d-f potential
              3
            2      6.34737691           104.88395571
            2      3.17368846             8.75584805
            2      2.01788111           -12.01796094
            -W     0
            W-ECP     3     60
            f potential
              1
            2      2.25888846            14.15257947
            s-f potential
              3
            2     14.32285640          1192.39588226
            2      7.16142810            32.52293315
            2      2.25888846           -14.15257947
            p-f potential
              3
            2     10.02164110           359.03196711
            2      5.01082040            24.03038019
            2      2.25888846           -14.15257947
            d-f potential
              3
            2      6.59799743           108.30134897
            2      3.29899871            10.98252827
            2      2.25888846           -14.15257947
            -RE     0
            RE-ECP     3     60
            f potential
              1
            2      2.50865059            16.44985227
            s-f potential
              3
            2     14.09930510          1038.95157226
            2      7.04965250            29.56173830
            2      2.50865059           -16.44985227
            p-f potential
              3
            2     10.10771690           339.54350965
            2      5.05385830            24.91369646
            2      2.50865059           -16.44985227
            d-f potential
              3
            2      6.84861794           111.69965275
            2      3.42430897            12.62432927
            2      2.50865059           -16.44985227
            -OS     0
            OS-ECP     3     60
            f potential
              1
            2      2.76707510            18.90945701
            s-f potential
              3
            2     13.87575390           885.40571914
            2      6.93787690            25.96704014
            2      2.76707510           -18.90945701
            p-f potential
              3
            2     10.19379260           320.08390185
            2      5.09689620            26.14876493
            2      2.76707510           -18.90945701
            d-f potential
              3
            2      7.09923846           115.04484313
            2      3.54961923            13.62257457
            2      2.76707510           -18.90945701
            -IR     0
            IR-ECP     3     60
            f potential
              1
            2      3.03407192            21.53103107
            s-f potential
              3
            2     13.65220260           732.26919978
            2      6.82610130            26.48472087
            2      3.03407192           -21.53103107
            p-f potential
              3
            2     10.27986840           299.48947357
            2      5.13993410            26.46623354
            2      3.03407192           -21.53103107
            d-f potential
              3
            2      7.34985897           124.45759451
            2      3.67492949            14.03599518
            2      3.03407192           -21.53103107
            -PT     0
            PT-ECP     3     60
            f potential
              1
            2      3.30956857            24.31437573
            s-f potential
              3
            2     13.42865130           579.22386092
            2      6.71432560            29.66949062
            2      3.30956857           -24.31437573
            p-f potential
              3
            2     10.36594420           280.86077422
            2      5.18297210            26.74538204
            2      3.30956857           -24.31437573
            d-f potential
              3
            2      7.60047949           120.39644429
            2      3.80023974            15.81092058
            2      3.30956857           -24.31437573
            -AU     0
            AU-ECP     3     60
            f potential
              2
            2      4.78982000            30.49008890
            2      2.39491000             5.17107381
            s-f potential
              4
            2     13.20510000           426.84667920
            2      6.60255000            37.00708285
            2      4.78982000           -30.49008890
            2      2.39491000            -5.17107381
            p-f potential
              4
            2     10.45202000           261.19958038
            2      5.22601000            26.96249604
            2      4.78982000           -30.49008890
            2      2.39491000            -5.17107381
            d-f potential
              4
            2      7.85110000           124.79066561
            2      3.92555000            16.30072573
            2      4.78982000           -30.49008890
            2      2.39491000            -5.17107381
            -HG     0
            HG-ECP     3     60
            f potential
              1
            2      3.88579112            30.36499643
            s-f potential
              3
            2     12.98154870           275.73721174
            2      6.49077440            49.08921249
            2      3.88579112           -30.36499643
            p-f potential
              3
            2     10.53809580           241.54007398
            2      5.26904790            27.39659081
            2      3.88579112           -30.36499643
            d-f potential
              3
            2      8.10172051           127.86700761
            2      4.05086026            16.60831151
            2      3.88579112           -30.36499643
            -TL     0
            TL-ECP     3     60
            f potential
              4
            2      5.62639900            15.82548800
            2      5.54895200            21.10402100
            2      2.87494600             2.91512700
            2      2.82145100             3.89690300
            s-f potential
              6
            2     12.16780500           281.28466300
            2      8.29490900            62.43425100
            2      5.62639900           -15.82548800
            2      5.54895200           -21.10402100
            2      2.87494600            -2.91512700
            2      2.82145100            -3.89690300
            p-f potential
              8
            2      7.15149200             4.63340800
            2      5.17286500             9.34175600
            2      9.89107200            72.29925300
            2      9.00339100           144.55803700
            2      5.62639900           -15.82548800
            2      5.54895200           -21.10402100
            2      2.87494600            -2.91512700
            2      2.82145100            -3.89690300
            d-f potential
              8
            2      7.13021800            35.94303900
            2      6.92690600            53.90959300
            2      5.41757000            10.38193900
            2      5.13868100            15.58382200
            2      5.62639900           -15.82548800
            2      5.54895200           -21.10402100
            2      2.87494600            -2.91512700
            2      2.82145100            -3.89690300
            -PB     0
            PB-ECP     3     60
            f potential
              2
            2      3.88751200            12.20989200
            2      3.81196300            16.19029100
            s-f potential
              4
            2     12.29630300           281.28549900
            2      8.63263400            62.52021700
            2      3.88751200           -12.20989200
            2      3.81196300           -16.19029100
            p-f potential
              6
            2     10.24179000            72.27689700
            2      8.92417600           144.59108300
            2      6.58134200             4.75869300
            2      6.25540300             9.94062100
            2      3.88751200           -12.20989200
            2      3.81196300           -16.19029100
            d-f potential
              6
            2      7.75433600            35.84850700
            2      7.72028100            53.72434200
            2      4.97026400            10.11525600
            2      4.56378900            14.83373100
            2      3.88751200           -12.20989200
            2      3.81196300           -16.19029100
            -BI     0
            BI-ECP     3     60
            f potential
              2
            2      4.21454600            13.71338300
            2      4.13340000            18.19430800
            s-f potential
              4
            2     13.04309000           283.26422700
            2      8.22168200            62.47195900
            2      4.21454600           -13.71338300
            2      4.13340000           -18.19430800
            p-f potential
              6
            2     10.46777700            72.00149900
            2      9.11890100           144.00227700
            2      6.75479100             5.00794500
            2      6.25259200             9.99155000
            2      4.21454600           -13.71338300
            2      4.13340000           -18.19430800
            d-f potential
              6
            2      8.08147400            36.39625900
            2      7.89059500            54.59766400
            2      4.95555600             9.98429400
            2      4.70455900            14.98148500
            2      4.21454600           -13.71338300
            2      4.13340000           -18.19430800
            -PO     0
            PO-ECP     3     60
            f potential
              4
            2      5.01327000            17.42829500
            2      4.98464000            23.38035300
            2      1.32676000             0.16339200
            2      1.52875800             0.32456600
            s-f potential
              6
            2     13.27722700           283.24470600
            2      8.39951800            62.39646100
            2      5.01327000           -17.42829500
            2      4.98464000           -23.38035300
            2      1.32676000            -0.16339200
            2      1.52875800            -0.32456600
            p-f potential
              8
            2     10.66568200            71.99171600
            2      9.28375300           143.97187100
            2      6.87274900             4.94961500
            2      6.32615000             9.74049900
            2      5.01327000           -17.42829500
            2      4.98464000           -23.38035300
            2      1.32676000            -0.16339200
            2      1.52875800            -0.32456600
            d-f potential
              8
            2      8.21486600            36.37838300
            2      8.00869600            54.56271500
            2      5.05522700             9.88949900
            2      4.78255300            14.69387700
            2      5.01327000           -17.42829500
            2      4.98464000           -23.38035300
            2      1.32676000            -0.16339200
            2      1.52875800            -0.32456600
            -AT     0
            AT-ECP     3     60
            f potential
              4
            2      5.81216300            19.87019800
            2      5.75371500            26.41645200
            2      2.51347200             0.99497000
            2      2.53626100             1.49070100
            s-f potential
              7
            2     30.20083200            49.95715800
            2     13.61230600           283.21037100
            2      8.52934000            62.28105200
            2      5.81216300           -19.87019800
            2      5.75371500           -26.41645200
            2      2.51347200            -0.99497000
            2      2.53626100            -1.49070100
            p-f potential
              8
            2     10.85406500            71.98237100
            2      9.46822900           143.90353200
            2      7.03111400             4.87175900
            2      6.14385800             8.98305900
            2      5.81216300           -19.87019800
            2      5.75371500           -26.41645200
            2      2.51347200            -0.99497000
            2      2.53626100            -1.49070100
            d-f potential
              8
            2      8.31351500            36.36323700
            2      7.99896500            54.54897000
            2      5.17996600             9.77628500
            2      4.94222600            14.26475500
            2      5.81216300           -19.87019800
            2      5.75371500           -26.41645200
            2      2.51347200            -0.99497000
            2      2.53626100            -1.49070100
            -RN     0
            RN-ECP     3     60
            f potential
              4
            2      6.34857100            21.79729000
            2      6.29594900            28.94680500
            2      2.88211800             1.44736500
            2      2.90804800             2.17796400
            s-f potential
              7
            2     30.15124200            49.96555100
            2     14.52124100           283.07000000
            2      8.05203800            62.00287000
            2      6.34857100           -21.79729000
            2      6.29594900           -28.94680500
            2      2.88211800            -1.44736500
            2      2.90804800            -2.17796400
            p-f potential
              8
            2     11.00994200            71.96911900
            2      9.61762500           143.86055900
            2      7.33600800             4.71476100
            2      6.40625300             9.01306500
            2      6.34857100           -21.79729000
            2      6.29594900           -28.94680500
            2      2.88211800            -1.44736500
            2      2.90804800            -2.17796400
            d-f potential
              8
            2      8.36922000            36.36836500
            2      8.11697500            54.55176100
            2      5.35365600             9.63448700
            2      5.09721200            14.38790200
            2      6.34857100           -21.79729000
            2      6.29594900           -28.94680500
            2      2.88211800            -1.44736500
            2      2.90804800            -2.17796400
            
 Initial command:
 /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe "/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/B3LYPDBJ_def2SVPD/06_betapinene_STD/Gau-26806.inp" -scrdir="/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/B3LYPDBJ_def2SVPD/06_betapinene_STD/"
 Entering Link 1 = /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe PID=     26809.
  
 Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2016,
            Gaussian, Inc.  All Rights Reserved.
  
 This is part of the Gaussian(R) 16 program.  It is based on
 the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.),
 the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),
 the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.),
 the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.),
 the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.),
 the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.),
 the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
 the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
 University), and the Gaussian 82(TM) system (copyright 1983,
 Carnegie Mellon University). Gaussian is a federally registered
 trademark of Gaussian, Inc.
  
 This software contains proprietary and confidential information,
 including trade secrets, belonging to Gaussian, Inc.
  
 This software is provided under written license and may be
 used, copied, transmitted, or stored only in accord with that
 written license.
  
 The following legend is applicable only to US Government
 contracts under FAR:
  
                    RESTRICTED RIGHTS LEGEND
  
 Use, reproduction and disclosure by the US Government is
 subject to restrictions as set forth in subparagraphs (a)
 and (c) of the Commercial Computer Software - Restricted
 Rights clause in FAR 52.227-19.
  
 Gaussian, Inc.
 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492
  
  
 ---------------------------------------------------------------
 Warning -- This program may not be used in any manner that
 competes with the business of Gaussian, Inc. or will provide
 assistance to any competitor of Gaussian, Inc.  The licensee
 of this program is prohibited from giving any competitor of
 Gaussian, Inc. access to this program.  By using this program,
 the user acknowledges that Gaussian, Inc. is engaged in the
 business of creating and licensing software in the field of
 computational chemistry and represents and warrants to the
 licensee that it is not a competitor of Gaussian, Inc. and that
 it will not use this program in any manner prohibited above.
 ---------------------------------------------------------------
  

 Cite this work as:
 Gaussian 16, Revision A.03,
 M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, 
 M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, 
 G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, 
 J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, 
 J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, 
 F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, 
 T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, 
 G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, 
 J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, 
 T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, 
 F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, 
 V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, 
 K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, 
 J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, 
 J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, 
 J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2016.
 
 ******************************************
 Gaussian 16:  ES64L-G16RevA.03 25-Dec-2016
                16-Jul-2021 
 ******************************************
 %NoSave
 %nproc=8
 Will use up to    8 processors via shared memory.
 %mem=42GB
 %chk=06_betapinene_STD_B3LYPDBJ-def2SVPDr
 ----------------------------------------------------------------------
 #P B3LYP/Gen EmpiricalDispersion=GD3BJ Integral=UltraFineGrid SCF=(NoS
 ymm,MaxCyc=120) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq
 ----------------------------------------------------------------------
 1/29=2,38=1,83=21,172=1/1;
 2/12=2,40=1/2;
 3/5=7,11=2,14=-4,25=1,30=1,36=2,74=-5,75=-5,116=-2,124=41/1,2,3;
 4/5=1,9=2/1;
 5/5=2,7=120,38=6,98=1/2;
 8/6=4,10=90,11=11/1;
 10/13=10,49=112,72=3/2;
 6/7=2,8=2,9=2,10=2,28=1/1;
 7/8=1,25=21/16;
 99/5=1/99;
 Leave Link    1 at Fri Jul 16 13:10:02 2021, MaxMem=  5637144576 cpu:               0.9 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l101.exe)
 -----------------
 ROA calculations.
 -----------------
 Structure from the checkpoint file:  "06_betapinene_STD_B3LYPDBJ-def2SVPDr.chk"
 Charge =  0 Multiplicity = 1
 No Z-Matrix found in chk file; cartesian coordinates used.
  C                                                 1.736209000000      0.801878000000      0.378732000000
  C                                                 0.496901000000      1.638940000000      0.787068000000
  C                                                 1.383096000000     -0.522443000000     -0.274501000000
  C                                                 2.201969000000     -1.569072000000     -0.279208000000
  C                                                 0.025556000000     -0.542713000000     -0.909694000000
  C                                                -1.066183000000     -0.286051000000      0.196211000000
  C                                                -0.738063000000      1.227450000000     -0.016143000000
  C                                                -0.309046000000      0.871194000000     -1.461941000000
  H                                                 2.398518000000      0.639455000000      1.229830000000
  H                                                 0.705457000000      2.697786000000      0.618767000000
  H                                                 0.292720000000      1.530390000000      1.853834000000
  H                                                 3.163814000000     -1.541544000000      0.219131000000
  H                                                 1.937671000000     -2.488500000000     -0.787055000000
  H                                                -0.114313000000     -1.410379000000     -1.555412000000
  C                                                -0.857617000000     -0.904210000000      1.570339000000
  C                                                -2.466835000000     -0.645129000000     -0.296336000000
  H                                                -1.560459000000      1.932149000000      0.122182000000
  H                                                -1.140268000000      0.855938000000     -2.161136000000
  H                                                 0.507286000000      1.443130000000     -1.902380000000
  H                                                 0.139287000000     -0.735039000000      1.971262000000
  H                                                -1.004924000000     -1.985930000000      1.522168000000
  H                                                -1.583414000000     -0.502658000000      2.282629000000
  H                                                -2.691969000000     -0.231611000000     -1.278562000000
  H                                                -3.219726000000     -0.269790000000      0.401530000000
  H                                                -2.582631000000     -1.729976000000     -0.357089000000
  H                                                 2.317034000000      1.377511000000     -0.346860000000
 Recover connectivity data from disk.
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 ITRead=  0  0  0  0  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 MicOpt= -1 -1 -1 -1 -1 -1
 NAtoms=     26 NQM=       26 NQMF=       0 NMMI=      0 NMMIF=      0
                NMic=       0 NMicF=      0.
                    Isotopes and Nuclear Properties:
 (Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
  in nuclear magnetons)

  Atom         1           2           3           4           5           6           7           8           9          10
 IAtWgt=          12          12          12          12          12          12          12          12           1           1
 AtmWgt=  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000   1.0078250   1.0078250
 NucSpn=           0           0           0           0           0           0           0           0           1           1
 AtZEff=   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   2.7928460   2.7928460
 AtZNuc=   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   1.0000000   1.0000000

  Atom        11          12          13          14          15          16          17          18          19          20
 IAtWgt=           1           1           1           1          12          12           1           1           1           1
 AtmWgt=   1.0078250   1.0078250   1.0078250   1.0078250  12.0000000  12.0000000   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           1           1           1           1           0           0           1           1           1           1
 AtZEff=   1.0000000   1.0000000   1.0000000   1.0000000   3.6000000   3.6000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460   2.7928460   2.7928460   0.0000000   0.0000000   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000   1.0000000   1.0000000   6.0000000   6.0000000   1.0000000   1.0000000   1.0000000   1.0000000

  Atom        21          22          23          24          25          26
 IAtWgt=           1           1           1           1           1           1
 AtmWgt=   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           1           1           1           1           1           1
 AtZEff=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 Using perturbation frequencies:    0.093368
 Leave Link  101 at Fri Jul 16 13:10:03 2021, MaxMem=  5637144576 cpu:               2.2 elap:               0.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l202.exe)
                          Input orientation:                          
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0        1.736209    0.801878    0.378732
      2          6           0        0.496901    1.638940    0.787068
      3          6           0        1.383096   -0.522443   -0.274501
      4          6           0        2.201969   -1.569072   -0.279208
      5          6           0        0.025556   -0.542713   -0.909694
      6          6           0       -1.066183   -0.286051    0.196211
      7          6           0       -0.738063    1.227450   -0.016143
      8          6           0       -0.309046    0.871194   -1.461941
      9          1           0        2.398518    0.639455    1.229830
     10          1           0        0.705457    2.697786    0.618767
     11          1           0        0.292720    1.530390    1.853834
     12          1           0        3.163814   -1.541544    0.219131
     13          1           0        1.937671   -2.488500   -0.787055
     14          1           0       -0.114313   -1.410379   -1.555412
     15          6           0       -0.857617   -0.904210    1.570339
     16          6           0       -2.466835   -0.645129   -0.296336
     17          1           0       -1.560459    1.932149    0.122182
     18          1           0       -1.140268    0.855938   -2.161136
     19          1           0        0.507286    1.443130   -1.902380
     20          1           0        0.139287   -0.735039    1.971262
     21          1           0       -1.004924   -1.985930    1.522168
     22          1           0       -1.583414   -0.502658    2.282629
     23          1           0       -2.691969   -0.231611   -1.278562
     24          1           0       -3.219726   -0.269790    0.401530
     25          1           0       -2.582631   -1.729976   -0.357089
     26          1           0        2.317034    1.377511   -0.346860
 ---------------------------------------------------------------------
                    Distance matrix (angstroms):
                    1          2          3          4          5
     1  C    0.000000
     2  C    1.550257   0.000000
     3  C    1.518298   2.565901   0.000000
     4  C    2.504241   3.786231   1.328912   0.000000
     5  C    2.528695   2.803708   1.498932   2.487509   0.000000
     6  C    3.011695   2.549105   2.505278   3.543019   1.575054
     7  C    2.541468   1.529578   2.761918   4.066144   2.124859
     8  C    2.752444   2.509388   2.493107   3.695802   1.554371
     9  H    1.090597   2.193435   2.155018   2.682055   3.406763
    10  H    2.171298   1.092234   3.409838   4.609987   3.646819
    11  H    2.188679   1.091541   3.151643   4.219214   3.464999
    12  H    2.748664   4.189326   2.110260   1.083626   3.481461
    13  H    3.496603   4.646444   2.106097   1.083102   2.730808
    14  H    3.472668   3.893474   2.161341   2.649348   1.090578
    15  C    3.325447   2.985941   2.927452   3.636472   2.657299
    16  C    4.496123   3.895442   3.851947   4.759380   2.568795
    17  H    3.494474   2.181920   3.853167   5.155146   3.115310
    18  H    3.837704   3.461982   3.438996   4.537937   2.209407
    19  H    2.669256   2.696587   2.698242   3.818376   2.271797
    20  H    2.729180   2.676935   2.575987   3.164630   2.889608
    21  H    4.073467   3.991933   3.327530   3.701741   3.009770
    22  H    4.043085   3.339290   3.916566   4.693546   3.575097
    23  H    4.839781   4.234936   4.207003   5.170893   2.760034
    24  H    5.070531   4.195856   4.659058   5.616611   3.510791
    25  H    5.060049   4.705551   4.146317   4.787938   2.918494
    26  H    1.093250   2.160329   2.118325   2.949605   3.042189
                    6          7          8          9         10
     6  C    0.000000
     7  C    1.563151   0.000000
     8  C    2.159153   1.549615   0.000000
     9  H    3.732169   3.425832   3.824949   0.000000
    10  H    3.495790   2.156096   2.948729   2.734334   0.000000
    11  H    2.809589   2.156641   3.433806   2.370133   1.748873
    12  H    4.412444   4.790337   4.550611   2.522686   4.916823
    13  H    3.852367   4.643505   4.097652   3.750241   5.512917
    14  H    2.288745   3.117139   2.291775   4.274776   4.719756
    15  C    1.521134   2.659923   3.556362   3.619567   4.040181
    16  C    1.527536   2.563925   2.883388   5.258422   4.698503
    17  H    2.273807   1.091819   2.280593   4.309459   2.442780
    18  H    2.620441   2.213772   1.086295   4.905968   3.811426
    19  H    3.141649   2.270529   1.089723   3.746117   2.823051
    20  H    2.192157   2.927607   3.816788   2.746467   3.732838
    21  H    2.156734   3.572594   4.189548   4.308309   5.067419
    22  H    2.160460   2.998707   4.187277   4.274177   4.272026
    23  H    2.195700   2.745962   2.632134   5.741415   4.870701
    24  H    2.163370   2.928281   3.639564   5.751302   4.925521
    25  H    2.165797   3.502148   3.627116   5.739718   5.600794
    26  H    3.809005   3.076607   2.897595   1.742790   2.296245
                   11         12         13         14         15
    11  H    0.000000
    12  H    4.511343   0.000000
    13  H    5.082483   1.847312   0.000000
    14  H    4.520703   3.729923   2.441998   0.000000
    15  C    2.707568   4.289973   3.985087   3.252542   0.000000
    16  C    4.119619   5.724812   4.799843   2.775831   2.478141
    17  H    2.567937   5.864699   5.710146   4.009757   3.261300
    18  H    4.316054   5.471628   4.748376   2.560406   4.135447
    19  H    3.763349   4.523962   4.329857   2.940967   4.408258
    20  H    2.273653   3.587224   3.730566   3.599698   1.087739
    21  H    3.762763   4.390189   3.774116   3.255141   1.092766
    22  H    2.799469   5.279534   5.075881   4.208655   1.093335
    23  H    4.671715   6.184594   5.173847   2.847885   3.454486
    24  H    4.205605   6.511544   5.738828   3.843716   2.710749
    25  H    4.877070   5.778336   4.603625   2.762375   2.715242
    26  H    2.994040   3.091644   3.909441   3.891578   4.354344
                   16         17         18         19         20
    16  C    0.000000
    17  H    2.763881   0.000000
    18  H    2.736871   2.558971   0.000000
    19  H    3.973109   2.934887   1.768102   0.000000
    20  H    3.455714   3.663622   4.609250   4.459254   0.000000
    21  H    2.691076   4.197609   4.654166   5.076688   1.753748
    22  H    2.729797   3.255202   4.667891   5.066697   1.765970
    23  H    1.089243   2.815006   2.090329   3.664579   4.339448
    24  H    1.093042   2.771234   3.486928   4.704542   3.736774
    25  H    1.092700   3.832192   3.467268   4.690854   3.717520
    26  H    5.194134   3.944943   3.939108   2.387286   3.818264
                   21         22         23         24         25
    21  H    0.000000
    22  H    1.764383   0.000000
    23  H    3.710505   3.739578   0.000000
    24  H    3.017667   2.504052   1.761447   0.000000
    25  H    2.467038   3.077800   1.762432   1.764521   0.000000
    26  H    5.083444   5.065841   5.342982   5.824895   5.802008
                   26
    26  H    0.000000
 Stoichiometry    C10H16
 Framework group  C1[X(C10H16)]
 Deg. of freedom    72
 Full point group                 C1      NOp   1
 RotChk:  IX=0 Diff= 6.48D-16
 Largest Abelian subgroup         C1      NOp   1
 Largest concise Abelian subgroup C1      NOp   1
                         Standard orientation:                         
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0        1.736209    0.801878    0.378732
      2          6           0        0.496901    1.638940    0.787068
      3          6           0        1.383096   -0.522443   -0.274501
      4          6           0        2.201969   -1.569072   -0.279208
      5          6           0        0.025556   -0.542713   -0.909694
      6          6           0       -1.066183   -0.286051    0.196211
      7          6           0       -0.738063    1.227450   -0.016143
      8          6           0       -0.309046    0.871194   -1.461941
      9          1           0        2.398518    0.639455    1.229830
     10          1           0        0.705457    2.697786    0.618767
     11          1           0        0.292720    1.530390    1.853834
     12          1           0        3.163814   -1.541544    0.219131
     13          1           0        1.937671   -2.488500   -0.787055
     14          1           0       -0.114313   -1.410379   -1.555412
     15          6           0       -0.857617   -0.904210    1.570339
     16          6           0       -2.466835   -0.645129   -0.296336
     17          1           0       -1.560459    1.932149    0.122182
     18          1           0       -1.140268    0.855938   -2.161136
     19          1           0        0.507286    1.443130   -1.902380
     20          1           0        0.139287   -0.735039    1.971262
     21          1           0       -1.004924   -1.985930    1.522168
     22          1           0       -1.583414   -0.502658    2.282629
     23          1           0       -2.691969   -0.231611   -1.278562
     24          1           0       -3.219726   -0.269790    0.401530
     25          1           0       -2.582631   -1.729976   -0.357089
     26          1           0        2.317034    1.377511   -0.346860
 ---------------------------------------------------------------------
 Rotational constants (GHZ):           1.9111302           1.2981916           1.1547870
 Leave Link  202 at Fri Jul 16 13:10:03 2021, MaxMem=  5637144576 cpu:               0.5 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l301.exe)
 General basis read from cards:  (5D, 7F)
 Centers:       9     10     11     12     13     14     17     18     19     20
 Centers:      21     22     23     24     25     26
 S 3 1.00
     Exponent=  1.3010701000D+01 Coefficients=  1.9682158000D-02
     Exponent=  1.9622572000D+00 Coefficients=  1.3796524000D-01
     Exponent=  4.4453796000D-01 Coefficients=  4.7831935000D-01
 S 1 1.00
     Exponent=  1.2194962000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  8.0000000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  1.1704099050D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       1      2      3      4      5      6      7      8     15     16
 S 5 1.00
     Exponent=  1.2384016938D+03 Coefficients=  5.4568832082D-03
     Exponent=  1.8629004992D+02 Coefficients=  4.0638409211D-02
     Exponent=  4.2251176346D+01 Coefficients=  1.8025593888D-01
     Exponent=  1.1676557932D+01 Coefficients=  4.6315121755D-01
     Exponent=  3.5930506482D+00 Coefficients=  4.4087173314D-01
 S 1 1.00
     Exponent=  4.0245147363D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  1.3090182668D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  6.7053540256D-02 Coefficients=  1.0000000000D+00
 P 3 1.00
     Exponent=  9.4680970621D+00 Coefficients=  3.8387871728D-02
     Exponent=  2.0103545142D+00 Coefficients=  2.1117025112D-01
     Exponent=  5.4771004707D-01 Coefficients=  5.1328172114D-01
 P 1 1.00
     Exponent=  1.5268613795D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  8.0000000000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.1713185140D-01 Coefficients=  1.0000000000D+00
 ****
 Ernie: Thresh=  0.10000D-02 Tol=  0.10000D-05 Strict=F.
 There are   348 symmetry adapted cartesian basis functions of A   symmetry.
 There are   328 symmetry adapted basis functions of A   symmetry.
   328 basis functions,   480 primitive gaussians,   348 cartesian basis functions
    38 alpha electrons       38 beta electrons
       nuclear repulsion energy       571.0056832907 Hartrees.
 IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000
 ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000
 IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=141
 NAtoms=   26 NActive=   26 NUniq=   26 SFac= 1.00D+00 NAtFMM=   60 NAOKFM=F Big=F
 Integral buffers will be    131072 words long.
 Raffenetti 2 integral format.
 Two-electron integral symmetry is turned on.
 R6Disp:  Grimme-D3(BJ) Dispersion energy=       -0.0493411780 Hartrees.
 Nuclear repulsion after empirical dispersion term =      570.9563421127 Hartrees.
 Leave Link  301 at Fri Jul 16 13:10:06 2021, MaxMem=  5637144576 cpu:              14.6 elap:               2.5
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l302.exe)
 NPDir=0 NMtPBC=     1 NCelOv=     1 NCel=       1 NClECP=     1 NCelD=      1
         NCelK=      1 NCelE2=     1 NClLst=     1 CellRange=     0.0.
 One-electron integrals computed using PRISM.
 One-electron integral symmetry used in STVInt
 NBasis=   328 RedAO= T EigKep=  1.46D-05  NBF=   328
 NBsUse=   328 1.00D-06 EigRej= -1.00D+00 NBFU=   328
 Precomputing XC quadrature grid using
 IXCGrd= 4 IRadAn=           5 IRanWt=          -1 IRanGd=           0 AccXCQ= 0.00D+00.
 Generated NRdTot=       0 NPtTot=           0 NUsed=           0 NTot=          32
 NSgBfM=   348   348   348   348   348 MxSgAt=    26 MxSgA2=    26.
 Leave Link  302 at Fri Jul 16 13:10:08 2021, MaxMem=  5637144576 cpu:              12.1 elap:               1.7
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l303.exe)
 DipDrv:  MaxL=2.
 Leave Link  303 at Fri Jul 16 13:10:08 2021, MaxMem=  5637144576 cpu:               1.2 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l401.exe)
 Initial guess from the checkpoint file:  "06_betapinene_STD_B3LYPDBJ-def2SVPDr.chk"
 SCF N**3 symmetry information disabled.
 B after Tr=     0.000000    0.000000   -0.000000
         Rot=    1.000000   -0.000000   -0.000000    0.000000 Ang=   0.00 deg.
 Guess basis will be translated and rotated to current coordinates.
 JPrj=2 DoOrth=T DoCkMO=T.
 Leave Link  401 at Fri Jul 16 13:10:10 2021, MaxMem=  5637144576 cpu:              11.2 elap:               1.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l502.exe)
 Integral symmetry usage will be decided dynamically.
 Closed shell SCF:
 Using DIIS extrapolation, IDIIS=  1040.
 NGot=  5637144576 LenX=  5636896046 LenY=  5636774501
 Requested convergence on RMS density matrix=1.00D-08 within 120 cycles.
 Requested convergence on MAX density matrix=1.00D-06.
 Requested convergence on             energy=1.00D-06.
 No special actions if energy rises.
 Fock matrices will be formed incrementally for  20 cycles.

 Cycle   1  Pass 1  IDiag  1:
 FoFJK:  IHMeth= 1 ICntrl=       0 DoSepK=F KAlg= 0 I1Cent=           0 FoldK=F
 IRaf= 990000000 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=F FulRan=T
         wScrn=  0.000000 ICntrl=         0 IOpCl=  0 I1Cent=           0 NGrid=           0
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 E= -390.443102461077    
 DIIS: error= 2.46D-03 at cycle   1 NSaved=   1.
 NSaved= 1 IEnMin= 1 EnMin= -390.443102461077     IErMin= 1 ErrMin= 2.46D-03
 ErrMax= 2.46D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 6.53D-03 BMatP= 6.53D-03
 IDIUse=3 WtCom= 9.75D-01 WtEn= 2.46D-02
 Coeff-Com:  0.100D+01
 Coeff-En:   0.100D+01
 Coeff:      0.100D+01
 Gap=     0.251 Goal=   None    Shift=    0.000
 GapD=    0.251 DampG=1.000 DampE=1.000 DampFc=1.0000 IDamp=-1.
 RMSDP=1.69D-02 MaxDP=2.01D+00              OVMax= 1.02D-02

 Cycle   2  Pass 1  IDiag  1:
 RMSU=  1.37D-02    CP:  1.42D+00
 E= -390.448672633454     Delta-E=       -0.005570172377 Rises=F Damp=F
 DIIS: error= 2.82D-04 at cycle   2 NSaved=   2.
 NSaved= 2 IEnMin= 2 EnMin= -390.448672633454     IErMin= 2 ErrMin= 2.82D-04
 ErrMax= 2.82D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 6.47D-05 BMatP= 6.53D-03
 IDIUse=3 WtCom= 9.97D-01 WtEn= 2.82D-03
 Coeff-Com: -0.138D-02 0.100D+01
 Coeff-En:   0.000D+00 0.100D+01
 Coeff:     -0.138D-02 0.100D+01
 Gap=     0.250 Goal=   None    Shift=    0.000
 RMSDP=7.56D-04 MaxDP=9.80D-02 DE=-5.57D-03 OVMax= 3.18D-03

 Cycle   3  Pass 1  IDiag  1:
 RMSU=  2.49D-04    CP:  1.44D+00  1.04D+00
 E= -390.448639154358     Delta-E=        0.000033479096 Rises=F Damp=F
 DIIS: error= 3.59D-04 at cycle   3 NSaved=   3.
 NSaved= 3 IEnMin= 2 EnMin= -390.448672633454     IErMin= 2 ErrMin= 2.82D-04
 ErrMax= 3.59D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.09D-04 BMatP= 6.47D-05
 IDIUse=3 WtCom= 3.46D-01 WtEn= 6.54D-01
 Coeff-Com: -0.111D-01 0.575D+00 0.436D+00
 Coeff-En:   0.000D+00 0.586D+00 0.414D+00
 Coeff:     -0.383D-02 0.582D+00 0.421D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=1.45D-04 MaxDP=9.60D-03 DE= 3.35D-05 OVMax= 2.53D-03

 Cycle   4  Pass 1  IDiag  1:
 RMSU=  1.03D-04    CP:  1.44D+00  1.04D+00  6.82D-01
 E= -390.448751554205     Delta-E=       -0.000112399847 Rises=F Damp=F
 DIIS: error= 5.25D-05 at cycle   4 NSaved=   4.
 NSaved= 4 IEnMin= 4 EnMin= -390.448751554205     IErMin= 4 ErrMin= 5.25D-05
 ErrMax= 5.25D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 3.28D-06 BMatP= 6.47D-05
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.587D-02 0.222D+00 0.198D+00 0.585D+00
 Coeff:     -0.587D-02 0.222D+00 0.198D+00 0.585D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=3.31D-05 MaxDP=1.19D-03 DE=-1.12D-04 OVMax= 1.30D-03

 Cycle   5  Pass 1  IDiag  1:
 RMSU=  2.12D-05    CP:  1.44D+00  1.04D+00  7.01D-01  8.18D-01
 E= -390.448753772511     Delta-E=       -0.000002218306 Rises=F Damp=F
 DIIS: error= 3.47D-05 at cycle   5 NSaved=   5.
 NSaved= 5 IEnMin= 5 EnMin= -390.448753772511     IErMin= 5 ErrMin= 3.47D-05
 ErrMax= 3.47D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 9.84D-07 BMatP= 3.28D-06
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.151D-02 0.233D-01 0.333D-01 0.362D+00 0.583D+00
 Coeff:     -0.151D-02 0.233D-01 0.333D-01 0.362D+00 0.583D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=1.10D-05 MaxDP=9.44D-04 DE=-2.22D-06 OVMax= 5.80D-04

 Cycle   6  Pass 1  IDiag  1:
 RMSU=  6.77D-06    CP:  1.44D+00  1.04D+00  7.01D-01  8.41D-01  8.18D-01
 E= -390.448754746753     Delta-E=       -0.000000974242 Rises=F Damp=F
 DIIS: error= 6.62D-06 at cycle   6 NSaved=   6.
 NSaved= 6 IEnMin= 6 EnMin= -390.448754746753     IErMin= 6 ErrMin= 6.62D-06
 ErrMax= 6.62D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.18D-08 BMatP= 9.84D-07
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.512D-03 0.241D-02 0.783D-02 0.151D+00 0.298D+00 0.541D+00
 Coeff:     -0.512D-03 0.241D-02 0.783D-02 0.151D+00 0.298D+00 0.541D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=2.84D-06 MaxDP=1.43D-04 DE=-9.74D-07 OVMax= 8.10D-05

 Cycle   7  Pass 1  IDiag  1:
 RMSU=  2.14D-06    CP:  1.44D+00  1.04D+00  7.02D-01  8.53D-01  7.92D-01
                    CP:  8.15D-01
 E= -390.448754786478     Delta-E=       -0.000000039725 Rises=F Damp=F
 DIIS: error= 1.49D-06 at cycle   7 NSaved=   7.
 NSaved= 7 IEnMin= 7 EnMin= -390.448754786478     IErMin= 7 ErrMin= 1.49D-06
 ErrMax= 1.49D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.73D-09 BMatP= 4.18D-08
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.108D-03-0.971D-03 0.412D-03 0.376D-01 0.912D-01 0.259D+00
 Coeff-Com:  0.613D+00
 Coeff:     -0.108D-03-0.971D-03 0.412D-03 0.376D-01 0.912D-01 0.259D+00
 Coeff:      0.613D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=8.45D-07 MaxDP=5.44D-05 DE=-3.97D-08 OVMax= 9.54D-06

 Cycle   8  Pass 1  IDiag  1:
 RMSU=  6.04D-07    CP:  1.44D+00  1.04D+00  7.01D-01  8.56D-01  7.91D-01
                    CP:  8.18D-01  8.19D-01
 E= -390.448754788984     Delta-E=       -0.000000002506 Rises=F Damp=F
 DIIS: error= 3.63D-07 at cycle   8 NSaved=   8.
 NSaved= 8 IEnMin= 8 EnMin= -390.448754788984     IErMin= 8 ErrMin= 3.63D-07
 ErrMax= 3.63D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 9.02D-11 BMatP= 2.73D-09
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.161D-05-0.493D-03-0.512D-03 0.196D-02 0.109D-01 0.523D-01
 Coeff-Com:  0.214D+00 0.722D+00
 Coeff:     -0.161D-05-0.493D-03-0.512D-03 0.196D-02 0.109D-01 0.523D-01
 Coeff:      0.214D+00 0.722D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=2.03D-07 MaxDP=5.53D-06 DE=-2.51D-09 OVMax= 2.38D-06

 Cycle   9  Pass 1  IDiag  1:
 RMSU=  1.28D-07    CP:  1.44D+00  1.04D+00  7.01D-01  8.56D-01  7.95D-01
                    CP:  8.20D-01  8.30D-01  8.01D-01
 E= -390.448754789064     Delta-E=       -0.000000000080 Rises=F Damp=F
 DIIS: error= 1.25D-07 at cycle   9 NSaved=   9.
 NSaved= 9 IEnMin= 9 EnMin= -390.448754789064     IErMin= 9 ErrMin= 1.25D-07
 ErrMax= 1.25D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 9.78D-12 BMatP= 9.02D-11
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.304D-05-0.211D-03-0.264D-03-0.405D-03 0.223D-02 0.163D-01
 Coeff-Com:  0.836D-01 0.361D+00 0.538D+00
 Coeff:      0.304D-05-0.211D-03-0.264D-03-0.405D-03 0.223D-02 0.163D-01
 Coeff:      0.836D-01 0.361D+00 0.538D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=3.95D-08 MaxDP=2.62D-06 DE=-7.99D-11 OVMax= 6.50D-07

 Cycle  10  Pass 1  IDiag  1:
 RMSU=  2.74D-08    CP:  1.44D+00  1.04D+00  7.01D-01  8.56D-01  7.95D-01
                    CP:  8.20D-01  8.29D-01  8.16D-01  7.99D-01
 E= -390.448754789125     Delta-E=       -0.000000000061 Rises=F Damp=F
 DIIS: error= 1.90D-08 at cycle  10 NSaved=  10.
 NSaved=10 IEnMin=10 EnMin= -390.448754789125     IErMin=10 ErrMin= 1.90D-08
 ErrMax= 1.90D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.04D-13 BMatP= 9.78D-12
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.144D-05-0.513D-04-0.678D-04-0.353D-03 0.144D-03 0.276D-02
 Coeff-Com:  0.191D-01 0.980D-01 0.222D+00 0.658D+00
 Coeff:      0.144D-05-0.513D-04-0.678D-04-0.353D-03 0.144D-03 0.276D-02
 Coeff:      0.191D-01 0.980D-01 0.222D+00 0.658D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=1.16D-08 MaxDP=1.80D-06 DE=-6.07D-11 OVMax= 1.31D-07

 Cycle  11  Pass 1  IDiag  1:
 RMSU=  8.18D-09    CP:  1.44D+00  1.04D+00  7.02D-01  8.56D-01  7.95D-01
                    CP:  8.20D-01  8.30D-01  8.19D-01  7.85D-01  8.51D-01
 E= -390.448754789145     Delta-E=       -0.000000000020 Rises=F Damp=F
 DIIS: error= 4.16D-09 at cycle  11 NSaved=  11.
 NSaved=11 IEnMin=11 EnMin= -390.448754789145     IErMin=11 ErrMin= 4.16D-09
 ErrMax= 4.16D-09  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.54D-14 BMatP= 4.04D-13
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.323D-06-0.538D-05-0.656D-05-0.108D-03-0.690D-04-0.616D-04
 Coeff-Com:  0.184D-02 0.135D-01 0.480D-01 0.255D+00 0.681D+00
 Coeff:      0.323D-06-0.538D-05-0.656D-05-0.108D-03-0.690D-04-0.616D-04
 Coeff:      0.184D-02 0.135D-01 0.480D-01 0.255D+00 0.681D+00
 Gap=     0.249 Goal=   None    Shift=    0.000
 RMSDP=2.87D-09 MaxDP=1.06D-07 DE=-2.02D-11 OVMax= 3.82D-08

 SCF Done:  E(RB3LYP) =  -390.448754789     A.U. after   11 cycles
            NFock= 11  Conv=0.29D-08     -V/T= 2.0125
 KE= 3.856316781933D+02 PE=-2.042836835866D+03 EE= 6.958000607713D+02
 Leave Link  502 at Fri Jul 16 13:13:15 2021, MaxMem=  5637144576 cpu:            1470.9 elap:             184.5
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l801.exe)
 DoSCS=F DFT=T ScalE2(SS,OS)=  1.000000  1.000000
 Range of M.O.s used for correlation:     1   328
 NBasis=   328 NAE=    38 NBE=    38 NFC=     0 NFV=     0
 NROrb=    328 NOA=    38 NOB=    38 NVA=   290 NVB=   290

 **** Warning!!: The largest alpha MO coefficient is  0.47463617D+02

 Leave Link  801 at Fri Jul 16 13:13:16 2021, MaxMem=  5637144576 cpu:               0.7 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1002.exe)
 Minotr:  Closed shell wavefunction.
          Direct CPHF calculation.
          Differentiating once with respect to electric field.
                with respect to dipole field.
                with respect to quadrupole field.
          Differentiating once with respect to magnetic field using GIAOs.
          Electric field/nuclear overlap derivatives assumed to be zero.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=F KeepS1=T KeepF1=T KeepIn=T MapXYZ=F SortEE=F KeepMc=T.
         7861 words used for storage of precomputed grid.
 Two-electron integral symmetry used by symmetrizing perturbed Fock matrices.
          MDV=    5637144576 using IRadAn=       1.
          Solving linear equations simultaneously, MaxMat=     384.
          Doing perturbations at frequencies    0.093368
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=T FulRan=T
         wScrn=  0.000000 ICntrl=      6100 IOpCl=  0 I1Cent=           7 NGrid=          26
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 FoFJK:  IHMeth= 1 ICntrl=    6127 DoSepK=F KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 CalDSu exits because no D1Ps are significant.
          There are    12 degrees of freedom in the 1st order CPHF.  IDoFFX=0 NUNeed=    12.
     11 vectors produced by pass  0 Test12= 1.84D-13 8.33D-09 XBig12= 1.00D+00 4.29D-01.
 AX will form    11 AO Fock derivatives at one time.
     11 vectors produced by pass  1 Test12= 1.84D-13 8.33D-09 XBig12= 1.86D-01 5.58D-02.
     11 vectors produced by pass  2 Test12= 1.84D-13 8.33D-09 XBig12= 3.95D-02 5.02D-02.
     11 vectors produced by pass  3 Test12= 1.84D-13 8.33D-09 XBig12= 4.37D-03 1.44D-02.
     11 vectors produced by pass  4 Test12= 1.84D-13 8.33D-09 XBig12= 4.07D-04 5.86D-03.
     11 vectors produced by pass  5 Test12= 1.84D-13 8.33D-09 XBig12= 1.38D-05 6.62D-04.
     11 vectors produced by pass  6 Test12= 1.84D-13 8.33D-09 XBig12= 2.42D-07 5.44D-05.
     11 vectors produced by pass  7 Test12= 1.84D-13 8.33D-09 XBig12= 2.91D-09 7.20D-06.
     11 vectors produced by pass  8 Test12= 1.84D-13 8.33D-09 XBig12= 3.98D-11 7.33D-07.
      8 vectors produced by pass  9 Test12= 1.84D-13 8.33D-09 XBig12= 3.44D-13 7.19D-08.
 InvSVY:  IOpt=1 It=  1 EMax= 2.84D-14
 Solved reduced A of dimension   107 with    12 vectors.
 FullF1:  Do perturbations      1 to      12.
 SCF Polarizability for W=    0.093368:
                1             2             3 
      1  0.128833D+03
      2 -0.786079D+01  0.120183D+03
      3  0.386789D+00  0.111981D+01  0.104445D+03
 Isotropic polarizability for W=    0.093368      117.82 Bohr**3.
 Dipole-quadrupole polarizability for W=    0.093368:
                 1             2             3 
      1   0.123295D+02 -0.316644D+02  0.465418D+01
      2   0.206915D+02 -0.800890D+01 -0.927699D+01
      3  -0.330210D+02  0.396733D+02  0.462280D+01
      4  -0.751977D+02  0.593936D+02  0.132454D+02
      5   0.664644D+01  0.193590D+02 -0.226951D+02
      6   0.984737D+01 -0.469554D+01  0.264520D+00
 Dipole-magnetic dipole polarizability for W=    0.093368:
                 1             2             3 
      1   0.420415D+01 -0.350793D+01  0.233606D+01
      2   0.825784D+01  0.236902D+01 -0.775970D+01
      3   0.108536D+02 -0.971532D+01 -0.680944D+01
 DQ contribution to OR G for W=    0.093368:
                 1             2             3 
      1   0.611355D+01  0.458144D+01  0.394088D+02
      2  -0.199226D+01  0.339808D+01  0.103259D+02
      3  -0.435333D+02 -0.387021D+02 -0.951163D+01
 Optical Rotation G' tensor for W=    0.093368:
                 1             2             3 
      1  -0.691819D+00 -0.863829D+00 -0.381298D+01
      2  -0.863829D+00 -0.453123D+00  0.821721D+00
      3  -0.381298D+01  0.821721D+00  0.908677D+00
 OR G Eigenvalues:    -3.7950    -0.7401     4.2989  Iso=     0.0788
 Eigenvectors:
   (1)   0.780021   0.048218   0.623892
   (2)   0.114546   0.969178  -0.218115
   (3)  -0.615180   0.241598   0.750456
 w=    0.093368 a.u., Optical Rotation Beta=      0.0788 au.
 Molar Mass =    136.2364 grams/mole, [Alpha] ( 4880.0 A) =       32.58 deg.
 PxScal for PaGxPb-FJK:  IOpCl= 0 ISclPx=1 IMOff=     1 NMtTot=    25 NTT=   53956 ScalPx= 2.98D+01
 PxSclF for G(T1ab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   53956 IRwP= 19996     0 IPTmp= 19977     0 ScalPx= 1.72D+03
 FullF1:  Do perturbations      1 to      30.
          There are    36 degrees of freedom in the 2nd order CPHF.
     30 vectors produced by pass  0 Test12= 3.06D-14 2.78D-09 XBig12= 1.00D+00 3.26D-01.
     30 vectors produced by pass  1 Test12= 3.06D-14 2.78D-09 XBig12= 3.37D-02 8.42D-02.
     30 vectors produced by pass  2 Test12= 3.06D-14 2.78D-09 XBig12= 1.19D-03 5.32D-03.
     30 vectors produced by pass  3 Test12= 3.06D-14 2.78D-09 XBig12= 2.02D-05 4.74D-04.
     30 vectors produced by pass  4 Test12= 3.06D-14 2.78D-09 XBig12= 1.32D-07 3.79D-05.
     30 vectors produced by pass  5 Test12= 3.06D-14 2.78D-09 XBig12= 5.80D-10 2.31D-06.
     30 vectors produced by pass  6 Test12= 3.06D-14 2.78D-09 XBig12= 1.52D-12 1.23D-07.
      8 vectors produced by pass  7 Test12= 3.06D-14 2.78D-09 XBig12= 3.15D-15 4.39D-09.
 InvSVY:  IOpt=1 It=  1 EMax= 2.00D-15
 Solved reduced A of dimension   218 with    30 vectors.
 PxScal for FxTab-FJK:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   53956 ScalPx= 1.93D+03
 PxScal for FxTab-XC:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   53956 ScalPx= 1.93D+03
 PxSclF for G(Xab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   53956 IRwP= 19978     0 IPTmp= 19973     0 ScalPx= 1.72D+03
 FullF1:  Do perturbations      1 to      30.
 End of Minotr F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.093368
 Property number 1 -- Alpha(-w,w) frequency  1    0.093368:
                 1             2             3 
      1   0.128833D+03 -0.786079D+01  0.386789D+00
      2  -0.786079D+01  0.120183D+03  0.111981D+01
      3   0.386789D+00  0.111981D+01  0.104445D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.093368:
                 1             2             3 
      1   0.420415D+01 -0.350793D+01  0.233606D+01
      2   0.825784D+01  0.236902D+01 -0.775970D+01
      3   0.108536D+02 -0.971532D+01 -0.680944D+01
 Property number 4 -- D-Q polarizability frequency  1    0.093368:
                 1             2             3 
      1   0.123295D+02 -0.316644D+02  0.465418D+01
      2   0.206915D+02 -0.800890D+01 -0.927699D+01
      3  -0.330210D+02  0.396733D+02  0.462280D+01
      4  -0.751977D+02  0.593936D+02  0.132454D+02
      5   0.664644D+01  0.193590D+02 -0.226951D+02
      6   0.984737D+01 -0.469554D+01  0.264520D+00
 End of Minotr F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    78 ND12= 1 LenFil=    2811:
 Frequencies=    0.093368
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1  -0.185877D+01 -0.212944D+01 -0.177401D+01 -0.985537D+00  0.113103D+01
      2  -0.212944D+01 -0.165956D+01  0.110733D+01  0.113103D+01 -0.400076D+01
      3  -0.177401D+01  0.110733D+01 -0.278540D+01  0.187203D+01  0.119075D+01
                 6             7             8             9            10 
      1   0.187203D+01 -0.337941D+01  0.200165D+01 -0.355209D+01 -0.545412D-01
      2   0.119075D+01  0.200165D+01  0.273123D+01 -0.106461D+01  0.224620D+01
      3  -0.545454D-01 -0.355209D+01 -0.106461D+01 -0.739650D+00  0.160603D+01
                11            12            13            14            15 
      1   0.224620D+01  0.160603D+01  0.185599D+01 -0.324935D+01 -0.162961D+00
      2  -0.334790D+01 -0.854287D-01 -0.324935D+01 -0.676123D+01  0.612896D+00
      3  -0.854287D-01  0.195767D+01 -0.162961D+00  0.612896D+00  0.913191D+00
                16            17            18            19            20 
      1   0.221360D+01  0.129509D+00  0.189268D+01 -0.131139D+02  0.938422D+01
      2   0.129509D+00  0.139543D+01 -0.231938D+00  0.938422D+01 -0.768116D+01
      3   0.189268D+01 -0.231938D+00 -0.578269D+01  0.308179D+01 -0.550428D+00
                21            22            23            24            25 
      1   0.308179D+01  0.890279D+01 -0.776102D+01 -0.131473D+01  0.340253D+00
      2  -0.550428D+00 -0.776102D+01  0.105068D+02 -0.213559D+01  0.418203D+00
      3  -0.137152D+01 -0.131473D+01 -0.213559D+01  0.216433D+01 -0.103966D+01
                26            27            28            29            30 
      1   0.418203D+00 -0.103966D+01  0.688836D+01 -0.656430D+01 -0.553643D+01
      2  -0.184039D+01  0.116142D+01 -0.656430D+01  0.743264D+01  0.253387D+01
      3   0.116142D+01  0.639914D-01 -0.553643D+01  0.253387D+01  0.218621D+01
                31            32            33            34            35 
      1  -0.951446D+01  0.840063D+01  0.473016D+00 -0.667077D+01  0.137936D+01
      2   0.840063D+01 -0.859623D+01  0.394680D+01  0.137936D+01  0.519331D+01
      3   0.473016D+00  0.394680D+01 -0.213427D+01  0.351979D+01 -0.330672D+01
                36            37            38            39            40 
      1   0.351979D+01  0.123834D+02 -0.581534D+01 -0.393982D+01 -0.220965D+01
      2  -0.330672D+01 -0.581534D+01  0.347659D+01 -0.579202D+00  0.267086D+01
      3  -0.794435D+00 -0.393982D+01 -0.579202D+00  0.252451D+01 -0.109769D+01
                41            42            43            44            45 
      1   0.267086D+01 -0.109769D+01 -0.744358D+01  0.361616D+00  0.313497D+01
      2   0.104148D+01  0.554547D+01  0.361616D+00  0.504875D+01  0.106478D+01
      3   0.554547D+01  0.859493D+00  0.313497D+01  0.106478D+01 -0.118817D+01
                46            47            48            49            50 
      1  -0.492559D+01  0.327311D+01  0.599810D+01  0.447410D+01 -0.489935D+01
      2   0.327311D+01 -0.276478D+01  0.937577D-01 -0.489935D+01 -0.728927D+01
      3   0.599810D+01  0.937577D-01 -0.232979D+01 -0.160773D+00 -0.452110D+00
                51            52            53            54            55 
      1  -0.160773D+00  0.117607D+02 -0.198492D+01 -0.274511D+01  0.192768D+01
      2  -0.452110D+00 -0.198492D+01  0.940795D+00  0.241767D+01 -0.327146D+01
      3   0.177020D+01 -0.274511D+01  0.241767D+01 -0.925444D+00 -0.245102D+01
                56            57            58            59            60 
      1  -0.327146D+01 -0.245102D+01 -0.328709D+01  0.611320D+01  0.955924D-01
      2   0.566724D+01 -0.110826D+00  0.611320D+01  0.385642D+01 -0.233534D+01
      3  -0.110826D+00 -0.132677D+01  0.955924D-01 -0.233534D+01  0.168691D+01
                61            62            63            64            65 
      1  -0.242905D+01 -0.661421D+00 -0.145620D+01  0.595667D-01 -0.876974D+00
      2  -0.661421D+00 -0.309620D+01  0.393598D+00 -0.876974D+00 -0.378861D+01
      3  -0.145620D+01  0.393598D+00  0.477363D+01  0.409282D+01  0.255271D+01
                66            67            68            69            70 
      1   0.409282D+01  0.798709D+00 -0.415128D+01  0.319763D+01  0.368180D+01
      2   0.255271D+01 -0.415128D+01  0.389176D+01 -0.130329D+01  0.174260D+01
      3   0.184668D+01  0.319763D+01 -0.130329D+01 -0.273857D+01  0.146484D+01
                71            72            73            74            75 
      1   0.174260D+01  0.146484D+01  0.449018D+01  0.590828D+00  0.264515D+01
      2  -0.273116D+00 -0.222688D+01  0.590828D+00  0.127994D+01  0.449471D+00
      3  -0.222688D+01 -0.120779D+01  0.264515D+01  0.449471D+00  0.243932D+01
                76            77            78            79            80 
      1  -0.677418D+00  0.723380D+00 -0.540641D+00  0.382802D+01  0.199191D+00
      2   0.723380D+00 -0.263520D-02  0.553316D+00  0.199191D+00  0.604864D+00
      3  -0.540641D+00  0.553316D+00 -0.279411D+00  0.327084D+01  0.809858D+00
                81            82            83            84            85 
      1   0.327084D+01  0.909542D+00  0.147742D+01 -0.956413D-01  0.154310D+01
      2   0.809858D+00  0.147742D+01  0.184737D+01  0.209917D+00  0.211584D+01
      3   0.429266D+01 -0.956413D-01  0.209917D+00 -0.103581D+00  0.252612D+00
                86            87            88            89            90 
      1   0.211584D+01  0.252612D+00 -0.655907D+00 -0.218016D+00 -0.167494D-01
      2   0.119636D+02  0.802749D+00 -0.218016D+00 -0.129288D+01  0.119129D+01
      3   0.802749D+00  0.100026D+01 -0.167494D-01  0.119129D+01  0.478979D+00
                91            92            93            94            95 
      1  -0.812002D+00 -0.125669D+00  0.970034D+00 -0.404942D+00 -0.201175D-02
      2  -0.125669D+00  0.403443D-01 -0.278667D+00 -0.201175D-02  0.680051D+00
      3   0.970034D+00 -0.278667D+00 -0.125714D+01  0.303695D-01  0.969314D+00
                96            97            98            99           100 
      1   0.303695D-01  0.130829D+01 -0.157289D-01 -0.907473D+00  0.952112D+01
      2   0.969314D+00 -0.157289D-01  0.161316D+01  0.181197D+01 -0.252443D+01
      3  -0.145418D+00 -0.907473D+00  0.181197D+01  0.863427D+01  0.295889D+01
               101           102           103           104           105 
      1  -0.252443D+01  0.295889D+01 -0.684016D+00  0.156074D+01  0.441416D+00
      2   0.185777D+01 -0.849805D+00  0.156074D+01 -0.160725D+01 -0.243686D+00
      3  -0.849805D+00  0.148332D+01  0.441416D+00 -0.243686D+00  0.180174D-01
               106           107           108           109           110 
      1   0.527618D+01 -0.891679D+00  0.145444D+01  0.105668D+01 -0.123190D+01
      2  -0.891679D+00 -0.545658D-01 -0.145287D-01 -0.123190D+01 -0.837474D+00
      3   0.145444D+01 -0.145287D-01  0.117102D+01  0.170368D+00 -0.107720D+01
               111           112           113           114           115 
      1   0.170368D+00 -0.155984D+01  0.148406D+01  0.445216D+00  0.595834D-01
      2  -0.107720D+01  0.148406D+01 -0.842413D+01 -0.310284D+01 -0.543873D-01
      3  -0.561839D+00  0.445216D+00 -0.310284D+01 -0.182527D+01 -0.243922D+00
               116           117           118           119           120 
      1  -0.543873D-01 -0.243922D+00 -0.600131D+00 -0.954438D+00 -0.463691D+00
      2  -0.415913D+01 -0.161982D+01 -0.954438D+00 -0.814168D+00 -0.391914D+00
      3  -0.161982D+01 -0.142550D+01 -0.463691D+00 -0.391914D+00 -0.706052D+00
               121           122           123           124           125 
      1  -0.165465D+01 -0.511971D+00 -0.470804D+00  0.620077D-01 -0.463799D+00
      2  -0.511971D+00 -0.536667D+01 -0.337021D+01 -0.463799D+00 -0.264940D+01
      3  -0.470804D+00 -0.337021D+01 -0.289806D+01 -0.564879D+00 -0.270657D+01
               126           127           128           129           130 
      1  -0.564879D+00 -0.249889D+01 -0.159618D+01 -0.468384D+01 -0.189993D+01
      2  -0.270657D+01 -0.159618D+01  0.124813D+01  0.176728D+00  0.211275D+01
      3  -0.364974D+01 -0.468384D+01  0.176728D+00  0.217071D+01  0.600124D+00
               131           132           133           134           135 
      1   0.211275D+01  0.600124D+00 -0.473520D+01  0.465149D+00  0.222616D+01
      2   0.680233D+01 -0.844429D+00  0.465149D+00  0.980750D-01 -0.253427D+01
      3  -0.844429D+00 -0.287196D+01  0.222616D+01 -0.253427D+01 -0.201425D+00
               136           137           138           139           140 
      1   0.411255D+00 -0.238047D+01 -0.428065D+01 -0.361912D+01  0.339814D+01
      2  -0.238047D+01  0.132305D+01  0.569086D-01  0.339814D+01  0.674796D+01
      3  -0.428065D+01  0.569086D-01  0.211407D+01  0.278184D+00  0.953490D+00
               141           142           143           144           145 
      1   0.278184D+00 -0.614169D+01  0.916683D+00  0.325932D+01 -0.613472D+01
      2   0.953490D+00  0.916683D+00  0.416219D+00 -0.256368D+01  0.425004D+01
      3  -0.285063D+01  0.325932D+01 -0.256368D+01  0.291050D+01  0.969719D+00
               146           147           148           149           150 
      1   0.425004D+01  0.969719D+00  0.328389D+01 -0.382231D+01 -0.210811D+00
      2  -0.453002D+01 -0.532496D+00 -0.382231D+01  0.531102D+01  0.925948D+00
      3  -0.532496D+00 -0.776640D+00 -0.210811D+00  0.925948D+00  0.740112D+00
               151           152           153           154           155 
      1   0.104633D+01 -0.363466D+00 -0.925433D+00 -0.461393D+01  0.864240D+00
      2  -0.363466D+00  0.112539D+01  0.125676D+01  0.864240D+00 -0.102948D+01
      3  -0.925433D+00  0.125676D+01  0.366746D+00 -0.329286D+01  0.668204D+00
               156           157           158           159           160 
      1  -0.329286D+01 -0.186563D+00 -0.488112D+00  0.371152D-01 -0.289293D+01
      2   0.668204D+00 -0.488112D+00  0.976046D-01 -0.741389D+00  0.558397D+00
      3  -0.396157D+01  0.371152D-01 -0.741389D+00  0.421544D+00 -0.328419D+01
               161           162           163           164           165 
      1   0.558397D+00 -0.328419D+01  0.300388D+01  0.194751D+01 -0.245783D+01
      2  -0.100305D+01  0.117030D+01  0.194751D+01  0.271526D+01 -0.210158D+01
      3   0.117030D+01 -0.549905D+01 -0.245783D+01 -0.210158D+01  0.294103D+01
               166           167           168           169           170 
      1   0.113022D+01  0.194560D+01 -0.125845D+01 -0.123301D+01 -0.107999D+01
      2   0.194560D+01  0.289318D+01 -0.210077D+01 -0.107999D+01 -0.148512D+01
      3  -0.125845D+01 -0.210077D+01  0.247659D+01  0.132403D+01  0.218811D+01
               171           172           173           174           175 
      1   0.132403D+01  0.526496D+01  0.614784D+00  0.172159D+01  0.778048D+00
      2   0.218811D+01  0.614784D+00  0.937624D+00 -0.269309D+00  0.510712D+00
      3  -0.343195D+01  0.172159D+01 -0.269309D+00  0.271006D+01 -0.654457D-01
               176           177           178           179           180 
      1   0.510712D+00 -0.654457D-01  0.152498D+01  0.620134D-01  0.152122D+01
      2  -0.265261D+00  0.417201D+00  0.620134D-01  0.345647D+00  0.183814D+00
      3   0.417201D+00  0.562098D+00  0.152122D+01  0.183814D+00  0.208428D+01
               181           182           183           184           185 
      1  -0.406952D+00 -0.978517D+00  0.718585D+00 -0.136669D+01 -0.178730D+01
      2  -0.978517D+00 -0.940707D+00  0.162478D+00 -0.178730D+01 -0.872345D+01
      3   0.718585D+00  0.162478D+00 -0.579314D+00  0.421617D+00  0.220196D+01
               186           187           188           189           190 
      1   0.421617D+00  0.218293D+00 -0.104196D+00 -0.395845D+00 -0.377891D+01
      2   0.220196D+01 -0.104196D+00  0.226607D-01 -0.772214D+00  0.531054D+00
      3  -0.178915D+01 -0.395845D+00 -0.772214D+00  0.355375D+00  0.349797D+01
               191           192           193           194           195 
      1   0.531054D+00  0.349797D+01  0.150505D+01 -0.957763D+00 -0.117137D+01
      2  -0.107884D+01 -0.188999D+00 -0.957763D+00  0.232607D+00  0.103680D+01
      3  -0.188999D+00 -0.412481D+01 -0.117137D+01  0.103680D+01  0.229573D+01
               196           197           198           199           200 
      1   0.257008D+01 -0.258639D+00 -0.317320D+01 -0.136527D+01  0.814925D+00
      2  -0.258639D+00  0.680284D+00  0.775325D+00  0.814925D+00 -0.331049D+00
      3  -0.317320D+01  0.775325D+00  0.563610D+01 -0.125642D+01  0.302151D+00
               201           202           203           204           205 
      1  -0.125642D+01  0.176242D+01 -0.697757D+00  0.560677D+00 -0.257857D+01
      2   0.302151D+00 -0.697757D+00  0.367237D+00 -0.117886D+01  0.491274D-01
      3  -0.162879D+01  0.560677D+00 -0.117886D+01  0.171921D+01 -0.271542D+01
               206           207           208           209           210 
      1   0.491274D-01 -0.271542D+01 -0.743410D+01  0.107783D+01  0.271891D+01
      2  -0.131639D+01  0.135283D+01  0.107783D+01 -0.919017D+00 -0.462005D+00
      3   0.135283D+01 -0.575238D+01  0.271891D+01 -0.462005D+00 -0.179436D+01
               211           212           213           214           215 
      1   0.319203D+01 -0.174061D+01 -0.831051D+00  0.578780D+01 -0.581920D+00
      2  -0.174061D+01  0.329549D+00  0.584869D+00 -0.581920D+00  0.920694D+00
      3  -0.831051D+00  0.584869D+00  0.108049D+01 -0.280414D+01  0.742510D+00
               216           217           218           219           220 
      1  -0.280414D+01 -0.123886D+01 -0.108635D+01  0.206039D+00 -0.318263D+01
      2   0.742510D+00 -0.108635D+01 -0.906664D+00 -0.924678D-01 -0.368115D+01
      3   0.226767D+01  0.206039D+00 -0.924678D-01 -0.199881D+00 -0.511118D+00
               221           222           223           224           225 
      1  -0.368115D+01 -0.511118D+00  0.421909D+00 -0.258083D+00 -0.904510D+00
      2  -0.828209D+01 -0.761252D+00 -0.258083D+00 -0.471176D+00 -0.799893D+00
      3  -0.761252D+00 -0.990638D+00 -0.904510D+00 -0.799893D+00 -0.494695D+00
               226           227           228           229           230 
      1   0.291995D+01  0.246329D+01 -0.112378D+01  0.200618D+01  0.158303D+01
      2   0.246329D+01  0.280349D+01 -0.743187D+00  0.158303D+01  0.459741D+01
      3  -0.112378D+01 -0.743187D+00  0.113389D+01 -0.909757D+00 -0.117180D+01
               231           232           233           234 
      1  -0.909757D+00 -0.193973D+01 -0.134725D+01  0.166054D+01
      2  -0.117180D+01 -0.134725D+01 -0.349510D+01  0.132089D+01
      3   0.869755D+00  0.166054D+01  0.132089D+01 -0.194229D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1   0.179003D+01 -0.165329D+01  0.325363D+01  0.686291D+00 -0.352446D+01
      2  -0.679563D+01  0.731028D+01 -0.484415D+01  0.627319D+01  0.490595D+01
      3   0.858036D+01 -0.818798D+01 -0.718851D+01 -0.242425D+01  0.613745D+01
                 6             7             8             9            10 
      1  -0.105411D+01  0.392532D+01  0.956136D+01  0.242985D+01 -0.178921D+01
      2  -0.412620D+00 -0.102662D+02 -0.615939D+01 -0.466833D+00  0.207587D+01
      3  -0.154511D+01 -0.100839D+02 -0.297160D+01 -0.286328D+01 -0.909032D+00
                11            12            13            14            15 
      1  -0.316383D+01 -0.415388D+01 -0.300375D+01 -0.111115D+02 -0.406457D+01
      2  -0.229215D+01  0.475381D+00 -0.314605D+01  0.233707D+01  0.564064D+00
      3   0.753942D+01  0.476963D+01  0.116685D+02 -0.525641D+01 -0.334561D+00
                16            17            18            19            20 
      1  -0.518400D+01  0.543057D+01  0.152864D+02 -0.260385D+01  0.180814D+01
      2  -0.481065D+01  0.709531D+00 -0.533399D+01  0.116782D+01  0.610308D+01
      3   0.636142D+01  0.298517D+00  0.310723D+01  0.396586D+01 -0.287708D+01
                21            22            23            24            25 
      1  -0.517772D+01 -0.644608D+00 -0.864996D+01  0.581106D+01 -0.907621D+01
      2  -0.391271D+01  0.374970D+01 -0.699709D+01  0.660971D+01 -0.145664D+02
      3  -0.377779D+01  0.118802D+02 -0.169122D+02  0.674050D+01  0.850946D+00
                26            27            28            29            30 
      1   0.143153D+02  0.184691D+01 -0.808841D+01 -0.298878D-01  0.436330D+01
      2   0.822325D+01 -0.193260D+01 -0.737502D+01  0.422538D+01  0.569205D+01
      3   0.318903D+01 -0.327122D+00  0.864555D+01 -0.130747D+02  0.323437D+01
                31            32            33            34            35 
      1  -0.393882D+01  0.107759D+02 -0.732825D+01  0.153093D+01 -0.439924D+00
      2  -0.327572D+01  0.150095D+02 -0.689153D+01 -0.133548D+01 -0.436194D+01
      3  -0.809516D+00  0.424092D+01 -0.113924D+02  0.891557D+01 -0.172233D+02
                36            37            38            39            40 
      1   0.329104D+01 -0.715880D+00 -0.175586D+01  0.260349D+01 -0.464504D+01
      2  -0.191964D+01  0.118649D+02 -0.739205D+01 -0.215496D+01 -0.358850D+01
      3   0.230926D+01 -0.258178D+01 -0.822816D-01  0.126484D+01  0.866928D+01
                41            42            43            44            45 
      1   0.767107D+01 -0.921195D+01  0.668460D+01 -0.444764D+01 -0.215886D+01
      2   0.363129D+01 -0.181533D+01 -0.163663D+02  0.420283D+01  0.412476D+01
      3  -0.474205D+01 -0.162574D+01  0.260042D+01  0.533265D+00 -0.221335D+01
                46            47            48            49            50 
      1   0.369389D+01 -0.353733D+00 -0.157788D+01 -0.176650D+01 -0.396443D+01
      2  -0.143037D+02  0.132105D+01  0.928951D+01  0.363361D+01 -0.102409D+01
      3   0.422555D+01 -0.105475D+02 -0.180809D+01 -0.121790D+01 -0.135863D+02
                51            52            53            54            55 
      1  -0.175028D+01 -0.383854D+01  0.816504D+01  0.546498D+00  0.350079D+01
      2  -0.371628D+01  0.428396D+01 -0.749364D+01  0.359795D+01  0.249820D+01
      3  -0.139553D+01 -0.546604D+01  0.107977D+01  0.736503D+01 -0.286323D+01
                56            57            58            59            60 
      1   0.148854D+01  0.520238D+01  0.223550D+01  0.430309D+01 -0.494991D+01
      2   0.239881D+01  0.409412D+01  0.140701D+01  0.208977D+01 -0.146924D+01
      3  -0.451260D+01 -0.405012D+01  0.352153D+01  0.134393D+02 -0.202906D+01
                61            62            63            64            65 
      1   0.312177D+01  0.229736D+01 -0.112672D+02 -0.171361D+01  0.352013D+01
      2  -0.149702D+01 -0.236669D+01 -0.561425D+01 -0.168854D+01 -0.536242D+01
      3  -0.531433D+01 -0.393113D+01 -0.319728D+01  0.133300D+01 -0.715125D+01
                66            67            68            69            70 
      1  -0.100474D+02  0.678210D+01 -0.852656D+01  0.410995D+01 -0.725909D+01
      2   0.115780D+02 -0.267348D+01 -0.703436D+01  0.889140D+01  0.411806D+01
      3   0.755433D+01 -0.163432D+01 -0.835743D+00  0.299003D+01  0.522315D+01
                71            72            73            74            75 
      1   0.726487D+01  0.841554D+01 -0.301037D+01  0.543051D+00 -0.295939D+01
      2   0.684651D+01  0.654109D+01  0.277056D+01  0.148094D+01  0.609118D+01
      3   0.163693D+01  0.170981D+01  0.388559D+01 -0.379720D+01  0.228224D+01
                76            77            78            79            80 
      1   0.287229D+00 -0.561931D-01 -0.122491D+00 -0.316279D+01  0.109813D+01
      2  -0.592850D+00  0.566509D+00 -0.779204D+00  0.316192D+01  0.205855D+01
      3  -0.320401D+00  0.208640D+01 -0.114471D+01  0.463290D+01 -0.232836D+01
                81            82            83            84            85 
      1  -0.446099D+01  0.168889D+01  0.188456D+01  0.913748D-01  0.124131D+01
      2   0.903740D+01 -0.995618D+00 -0.110199D+01  0.143000D+01 -0.171023D+01
      3   0.252771D+01  0.205358D+01  0.218275D+00 -0.656660D+00  0.554079D+01
                86            87            88            89            90 
      1   0.960826D+01 -0.467192D+01  0.140491D+00 -0.230313D+01  0.208705D+00
      2  -0.145518D+01  0.870020D+00 -0.663467D-01  0.464759D+00  0.161257D+00
      3  -0.273273D+01  0.428906D+00 -0.189244D+01  0.606985D+00 -0.580503D+00
                91            92            93            94            95 
      1  -0.251060D+01 -0.449025D+00  0.279535D+01 -0.671191D+00 -0.158955D+01
      2   0.140805D+01  0.504607D+00 -0.774880D+00  0.118015D+01  0.615485D+00
      3  -0.230526D+01 -0.222255D+01  0.177419D+01 -0.613209D+00  0.105999D+01
                96            97            98            99           100 
      1   0.137791D+01  0.251311D+01  0.166660D+01 -0.180044D+02  0.757699D+01
      2  -0.490264D+00 -0.533157D+01  0.711191D+00  0.565555D+01  0.106534D+02
      3  -0.542145D+00  0.367004D+01 -0.701203D+00 -0.215031D+01 -0.110120D+02
               101           102           103           104           105 
      1  -0.116021D+01  0.341906D+01  0.230604D+00  0.319505D+00 -0.151700D+00
      2  -0.476564D+01  0.822349D+01  0.115309D+01 -0.124428D+01  0.470285D+00
      3  -0.316298D+01 -0.365012D+01 -0.142102D+01  0.947904D+00  0.434109D-02
               106           107           108           109           110 
      1   0.344481D+01  0.766042D+00  0.180467D+01  0.195098D+01 -0.185937D+01
      2   0.262382D+01  0.200853D+01  0.522552D+01 -0.116922D+00 -0.277005D+01
      3  -0.866924D+01  0.119858D+01 -0.197442D+01  0.269952D+01  0.357446D+01
               111           112           113           114           115 
      1  -0.176732D+01  0.143300D+01 -0.270484D+01 -0.539550D+01 -0.199808D+01
      2  -0.811191D+00 -0.126010D+01 -0.723179D+01 -0.384806D+01 -0.921314D+00
      3   0.248832D+01  0.191902D+01  0.195269D+02  0.786409D+01  0.947078D+00
               116           117           118           119           120 
      1   0.109970D+01 -0.354302D+01  0.698773D+00  0.595817D+00 -0.134675D+00
      2  -0.495434D+01 -0.277247D+01 -0.492924D+00 -0.661963D+00  0.749162D+00
      3   0.120598D+02  0.421385D+01  0.727783D-01 -0.705293D+00 -0.718704D-01
               121           122           123           124           125 
      1  -0.335194D+00  0.573957D+01 -0.106840D+01 -0.174813D-01  0.331379D+01
      2  -0.289398D+01 -0.232144D+00  0.271644D+00 -0.247429D+01 -0.492318D+00
      3   0.486584D+01 -0.177603D-01  0.143652D+00  0.126690D+01  0.129979D+00
               126           127           128           129           130 
      1  -0.909739D+00 -0.906991D+01  0.200317D+01  0.279400D+01  0.591910D+01
      2  -0.426635D+00  0.136187D+02  0.119787D+01  0.100499D+02  0.232519D+01
      3   0.201099D+00  0.231420D+01  0.125079D+01  0.685074D+01  0.603874D+01
               131           132           133           134           135 
      1   0.147599D+02 -0.898451D+01  0.317687D+01 -0.484348D+00 -0.633756D+01
      2  -0.220081D+01  0.249857D+01  0.507193D+01  0.314390D+01 -0.399367D+01
      3   0.724386D+01 -0.120118D+01  0.669765D+01  0.827664D-01 -0.580102D+01
               136           137           138           139           140 
      1  -0.222435D+01 -0.796628D-01  0.259605D+01 -0.122852D+01 -0.151497D+01
      2   0.121341D+02 -0.190155D+01 -0.802384D+01 -0.307960D+01 -0.191648D+01
      3  -0.832153D+01  0.529663D+01  0.341265D+01  0.152983D+02  0.200729D+02
               141           142           143           144           145 
      1  -0.521486D+01  0.415219D+01 -0.908292D+00  0.418146D+01 -0.162485D+01
      2   0.938341D+01 -0.191295D+02  0.898028D+01 -0.108435D+02 -0.481762D-02
      3   0.347307D+01  0.394069D+01  0.280011D+01 -0.117544D+02 -0.732558D+01
               146           147           148           149           150 
      1   0.255245D+00  0.296837D+01  0.397827D+00 -0.143865D+01 -0.399666D+01
      2   0.554205D+00  0.324873D+01 -0.483380D+00 -0.568756D+00 -0.225334D+01
      3  -0.856979D+00  0.938365D+00  0.458010D+01  0.234031D+00  0.247142D+00
               151           152           153           154           155 
      1   0.178915D+01 -0.785843D+00 -0.610232D+00  0.302726D+01  0.292044D+01
      2  -0.240476D+00 -0.124541D+01 -0.528851D+00 -0.100049D+02  0.296496D+00
      3   0.167644D+01  0.107994D+01 -0.191722D+00 -0.598406D+01 -0.181704D+01
               156           157           158           159           160 
      1   0.410388D+01  0.109364D+01  0.141055D+01 -0.468954D+00  0.338740D+01
      2  -0.266853D+01 -0.549688D+00 -0.715143D+00 -0.674520D+00 -0.642899D+01
      3  -0.329559D+01  0.895798D+00 -0.150482D+00 -0.403241D+00 -0.329897D+01
               161           162           163           164           165 
      1   0.241572D+01  0.353656D+01 -0.169080D+01 -0.462405D+01 -0.402025D+00
      2  -0.232716D+00 -0.234349D+01  0.956484D+01  0.488074D+01 -0.393042D+01
      3  -0.110814D+01 -0.313076D+01  0.580983D+01  0.172427D+01 -0.336981D+01
               166           167           168           169           170 
      1  -0.232369D+01 -0.385893D+01 -0.130610D+01  0.321768D+00  0.226521D+01
      2   0.434034D+01  0.492424D+01 -0.306404D+01 -0.455335D+01 -0.314682D+01
      3   0.455553D+01  0.205681D+01 -0.225857D+01 -0.271750D+01 -0.540471D+00
               171           172           173           174           175 
      1   0.508294D-01  0.419984D+01  0.348146D+01  0.230284D+01  0.232582D+01
      2   0.293606D+01 -0.181626D+02 -0.174073D+01 -0.350877D+01 -0.203777D+01
      3   0.232251D+01 -0.720574D+01 -0.211529D+01 -0.254281D+01  0.599673D+00
               176           177           178           179           180 
      1   0.101562D+01  0.305998D+00  0.223923D+01  0.216852D+01  0.234570D+01
      2  -0.177029D+01 -0.716299D+00 -0.641874D+01 -0.813541D+00 -0.413215D+01
      3  -0.107072D+01 -0.901193D-02 -0.241306D+01 -0.773999D+00 -0.154218D+01
               181           182           183           184           185 
      1  -0.115880D+01 -0.173929D+01 -0.585434D+00 -0.317422D+01 -0.160997D+02
      2  -0.830877D+00  0.105329D+01  0.618480D+00  0.272455D+01 -0.309992D+00
      3  -0.135885D+01 -0.107306D+01  0.101389D+00  0.298557D+01 -0.897325D+01
               186           187           188           189           190 
      1  -0.124927D+01 -0.423875D+00  0.519387D+00 -0.129369D+01  0.524322D+01
      2   0.197328D+01 -0.878317D+00  0.310546D+00  0.448262D+00  0.407838D+01
      3   0.238053D+01 -0.109719D+00 -0.251270D+00 -0.227041D+00  0.377909D+01
               191           192           193           194           195 
      1  -0.384416D+01 -0.497895D+01 -0.297554D+01  0.222453D+01  0.334753D+01
      2  -0.115753D+01  0.510760D+00 -0.238689D+01  0.957089D-01 -0.124648D+01
      3  -0.352668D+01 -0.349790D+01 -0.155281D+01  0.142300D+01  0.211041D+01
               196           197           198           199           200 
      1  -0.418735D+01  0.444976D+01  0.738373D+01 -0.163135D+01  0.702657D+00
      2  -0.481223D+01 -0.365811D-01 -0.896202D+00  0.311436D+01 -0.609745D-01
      3  -0.292909D+01  0.215188D+01  0.387431D+01  0.297813D+01 -0.188388D+01
               201           202           203           204           205 
      1  -0.987482D+00  0.453208D+00 -0.169275D+01  0.145661D+01 -0.128502D+01
      2   0.481427D+01  0.690117D+00  0.360425D+01 -0.645062D+01  0.304908D+01
      3   0.156751D+01 -0.114592D+01  0.223302D+01 -0.414566D+01  0.108877D+01
               206           207           208           209           210 
      1   0.452380D+01 -0.526891D+01  0.180072D+01 -0.830192D+00 -0.924087D+00
      2  -0.550226D+01  0.178529D+02 -0.975279D+01  0.175735D+01  0.944259D+01
      3  -0.562025D+01  0.651725D+01  0.830264D+01 -0.617771D+01 -0.312225D+01
               211           212           213           214           215 
      1  -0.352899D+00  0.815999D+00 -0.283641D+00 -0.176634D+01  0.166723D+01
      2   0.321384D+01 -0.228384D+01 -0.442455D+01  0.820037D+01 -0.284903D+01
      3  -0.492964D+01  0.232266D+01  0.213612D+01 -0.440737D+01  0.446963D+01
               216           217           218           219           220 
      1   0.925740D+00  0.548654D+00  0.334943D+00 -0.422437D+00  0.355861D+00
      2  -0.887337D+01 -0.693105D+00  0.155687D-01  0.184139D+01  0.411530D+00
      3   0.413240D+01 -0.286027D+01 -0.354974D+01 -0.553917D+00 -0.488212D+01
               221           222           223           224           225 
      1   0.268227D+01 -0.370417D+01 -0.503142D+00  0.427860D+00 -0.377500D+00
      2   0.112400D+01  0.366216D+01  0.166783D+01  0.150937D+01  0.119533D+01
      3  -0.237115D+02 -0.179024D+01 -0.109947D+01 -0.163387D+01 -0.148490D+01
               226           227           228           229           230 
      1   0.211195D+01  0.200440D+01 -0.237503D+01  0.142518D+01  0.284626D+01
      2  -0.353840D+01 -0.333266D+01  0.470366D+01 -0.342404D+01 -0.391956D+01
      3  -0.198649D+01 -0.237519D+01  0.787550D+00  0.235375D+01 -0.896693D+01
               231           232           233           234 
      1  -0.365507D+01 -0.165749D+01 -0.395392D+01  0.253769D+01
      2   0.305782D+01  0.349855D+01  0.441641D+01 -0.689186D+01
      3   0.149190D+01  0.529174D+00  0.576644D+01 -0.842116D+00
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1  -0.749595D+01 -0.100129D+02 -0.656458D+01 -0.342566D+01 -0.631201D+00
      2   0.672111D+01  0.609646D+01  0.923171D+01  0.134926D+01  0.162623D+01
      3   0.774843D+00  0.391643D+01 -0.266713D+01  0.207641D+01 -0.995027D+00
      4  -0.817189D+01 -0.185354D+02  0.311973D+01 -0.455258D+01 -0.233923D+02
      5  -0.100135D+02  0.994458D+00 -0.172171D+02  0.703121D+01  0.489457D+01
      6  -0.123709D+01  0.766406D+01 -0.262063D+01  0.498294D+01  0.433763D+01
                 6             7             8             9            10 
      1   0.787450D+01 -0.777832D+01  0.812504D+01 -0.137540D+02 -0.558060D+01
      2  -0.259822D+01  0.119489D+02 -0.230637D+00  0.114526D+02  0.514630D+01
      3  -0.527627D+01 -0.417060D+01 -0.789440D+01  0.230142D+01  0.434301D+00
      4   0.776067D+01  0.864290D+01  0.180200D+02 -0.117223D+02 -0.121388D+01
      5   0.116528D+01 -0.215663D+02 -0.542059D+01 -0.941907D+01  0.218036D+01
      6  -0.244236D+01 -0.612734D+01 -0.682262D+01  0.189060D+00  0.743086D+01
                11            12            13            14            15 
      1   0.930628D+01 -0.173230D+01  0.128427D+02  0.219610D+02 -0.263367D+01
      2  -0.136142D+02 -0.446644D+00 -0.155520D+02 -0.449106D+02  0.766645D+00
      3   0.430795D+01  0.217895D+01  0.270927D+01  0.229496D+02  0.186703D+01
      4  -0.239834D+01  0.199585D+01  0.170797D+01 -0.140890D+02 -0.648064D+00
      5   0.122157D+01  0.158076D+01  0.117638D+01 -0.366834D+01  0.583517D+00
      6  -0.177787D+01  0.690393D+01 -0.362250D+01 -0.333931D+01  0.429395D+01
                16            17            18            19            20 
      1  -0.218897D+01 -0.444389D+01  0.150609D+02 -0.170880D+02  0.970517D+01
      2  -0.304642D+01  0.111187D+02  0.816779D+01 -0.805170D+01  0.109369D+02
      3   0.523538D+01 -0.667484D+01 -0.232287D+02  0.251397D+02 -0.206421D+02
      4   0.182013D+01 -0.193023D+01  0.392377D+01  0.545997D+02 -0.371043D+02
      5   0.401849D+01  0.883509D+00  0.306381D+01  0.213587D+02 -0.766850D+01
      6   0.602028D+01  0.152702D+01 -0.178863D+02 -0.110379D+02  0.343962D+01
                21            22            23            24            25 
      1   0.115295D+02  0.207391D+02 -0.177433D+02 -0.883405D+01 -0.124284D+00
      2  -0.693931D+01 -0.473806D+00 -0.714520D+01  0.131687D+02 -0.149355D+01
      3  -0.459024D+01 -0.202653D+02  0.248885D+02 -0.433470D+01  0.161783D+01
      4  -0.825967D+01 -0.454111D+02  0.602946D+02 -0.112478D+01 -0.414104D+01
      5  -0.644649D+01 -0.150396D+02  0.324948D+01  0.122929D+02  0.876237D+01
      6   0.858725D+01  0.650165D+01  0.242828D+01 -0.418067D+01  0.146350D+01
                26            27            28            29            30 
      1  -0.356234D+01 -0.435132D+01  0.558565D+01 -0.110936D+02 -0.223002D+02
      2   0.725713D+01 -0.840361D+01  0.656384D+01 -0.776049D+01  0.133546D+02
      3  -0.369479D+01  0.127549D+02 -0.121495D+02  0.188541D+02  0.894561D+01
      4  -0.332976D+01  0.986874D+01 -0.353568D+02  0.433163D+02  0.207656D+02
      5   0.245335D+01 -0.410126D+01 -0.411741D+02  0.177588D+02  0.144317D+02
      6   0.592275D+01 -0.142836D+01  0.213189D+02 -0.136251D+02 -0.797928D+01
                31            32            33            34            35 
      1  -0.134791D+02  0.205570D+02  0.157306D+02 -0.376472D+02  0.260284D+02
      2  -0.113267D+02  0.570998D+01 -0.206759D+02  0.244054D+02 -0.309272D+02
      3   0.248058D+02 -0.262670D+02  0.494537D+01  0.132418D+02  0.489881D+01
      4   0.517054D+02 -0.510264D+02  0.967452D+01  0.172479D+02  0.123774D+02
      5   0.601791D+01  0.103664D+02 -0.938894D+01  0.246080D+02 -0.193981D+02
      6  -0.409545D+01 -0.203251D+02  0.565957D+01 -0.153433D+02  0.145699D+02
                36            37            38            39            40 
      1   0.360295D+01  0.620171D+01 -0.626836D+01  0.272860D+01 -0.106371D+02
      2  -0.376505D+01  0.504216D+01  0.359560D+00 -0.502793D+01 -0.835984D+00
      3   0.162094D+00 -0.112439D+02  0.590880D+01  0.229933D+01  0.114730D+02
      4  -0.185210D+02 -0.321109D+02  0.104975D+02  0.495901D+01  0.522160D+01
      5  -0.105008D+02 -0.421332D+01  0.427082D+00 -0.370897D+00  0.293131D+01
      6  -0.167481D+01  0.516609D+01 -0.809397D+01 -0.371316D+01 -0.802328D+01
                41            42            43            44            45 
      1   0.249286D+02  0.682966D+01  0.148906D+02  0.471317D+01  0.422343D+01
      2  -0.572292D+01 -0.306163D+01 -0.963293D+01 -0.712926D+01  0.982894D-01
      3  -0.192056D+02 -0.376802D+01 -0.525765D+01  0.241609D+01 -0.432172D+01
      4  -0.925125D+01 -0.153195D+01  0.134803D+02 -0.519836D+01 -0.700978D+01
      5  -0.555602D+01  0.300455D+01 -0.652215D+01  0.317743D+01 -0.138343D+01
      6  -0.289400D+01 -0.200646D+02 -0.199171D+01 -0.160879D+02 -0.138341D+01
                46            47            48            49            50 
      1  -0.144720D+02 -0.539691D+01 -0.133349D+02 -0.209326D+01  0.880284D+00
      2   0.756299D+00  0.284431D+01  0.114854D+02  0.647284D+01 -0.490083D+00
      3   0.137157D+02  0.255260D+01  0.184946D+01 -0.437958D+01 -0.390202D+00
      4   0.389052D+01  0.329901D+01 -0.901272D+01  0.443835D+00  0.198027D+02
      5  -0.139808D+02 -0.151477D+01  0.819782D+01 -0.647487D+00 -0.189972D+01
      6  -0.601689D+01  0.438558D+00  0.401053D+01  0.846141D+00 -0.816187D+01
                51            52            53            54            55 
      1  -0.615842D+01 -0.174905D+02 -0.477000D+01  0.916794D+01 -0.345761D+01
      2  -0.312870D+01  0.133196D+02  0.226103D+01 -0.691130D+01 -0.850080D+01
      3   0.928712D+01  0.417095D+01  0.250896D+01 -0.225664D+01  0.119584D+02
      4  -0.166333D+01 -0.199427D+02 -0.691706D-01  0.240934D+01  0.177437D+02
      5  -0.486217D+01  0.105887D+02 -0.446458D+01  0.224766D+01  0.432841D+01
      6   0.281750D+01  0.439494D+01 -0.862151D+00  0.448509D+00 -0.508137D+01
                56            57            58            59            60 
      1   0.142638D+01  0.374310D+01 -0.253120D+01 -0.135640D+02  0.113571D+01
      2   0.131977D+02 -0.494911D+01  0.105572D+02  0.679824D+01  0.504020D+00
      3  -0.146241D+02  0.120601D+01 -0.802599D+01  0.676577D+01 -0.163973D+01
      4  -0.222502D+02 -0.465932D+01 -0.207361D+02  0.104071D+02  0.584100D+01
      5  -0.327603D+01 -0.631238D+00 -0.573228D+01  0.636953D+01  0.244252D+01
      6  -0.173101D+01 -0.827284D+01  0.681833D+00  0.423770D+01 -0.920325D+00
                61            62            63            64            65 
      1   0.325143D+01  0.414737D+01  0.275585D+01  0.607632D+01  0.972331D+01
      2  -0.236920D+01 -0.957111D+01  0.479874D+01  0.641131D+01 -0.654912D+01
      3  -0.882229D+00  0.542374D+01 -0.755459D+01 -0.124876D+02 -0.317419D+01
      4  -0.155481D+01  0.780216D+01 -0.306506D+01  0.179477D+00 -0.502275D+01
      5   0.104838D+01 -0.353314D+00 -0.120634D+01 -0.508902D+01  0.743078D+01
      6  -0.566000D+01  0.277905D+01  0.111712D+02  0.122068D+02  0.150099D+02
                66            67            68            69            70 
      1  -0.324143D+01  0.157221D+02 -0.104308D+02 -0.143958D+01 -0.233495D+00
      2   0.147530D+02 -0.393827D+01  0.401769D+01 -0.679147D+01  0.120235D+02
      3  -0.115116D+02 -0.117838D+02  0.641311D+01  0.823105D+01 -0.117900D+02
      4   0.732234D+01 -0.332008D+01 -0.400516D+01  0.347536D+01  0.133507D+00
      5  -0.171503D+02  0.211153D+01  0.894641D+01 -0.965424D+01 -0.150637D+02
      6  -0.124705D+01  0.136549D+02 -0.126734D+02  0.757729D-01  0.209444D+01
                71            72            73            74            75 
      1  -0.540845D+01 -0.586185D+01  0.235085D+02  0.242506D+01  0.114839D+02
      2   0.677583D+00 -0.230321D+01 -0.180888D+02 -0.198164D+01 -0.120942D+02
      3   0.473086D+01  0.816506D+01 -0.541970D+01 -0.443418D+00  0.610357D+00
      4   0.545091D+01  0.282375D+01  0.844702D+01  0.906443D+01  0.551460D+01
      5  -0.285241D+01 -0.539725D+01  0.207908D+02  0.324155D+01  0.182970D+02
      6  -0.308068D+01  0.199154D+01  0.244836D+01  0.142371D+01  0.342263D+01
                76            77            78            79            80 
      1  -0.425194D+01  0.135245D+01 -0.259337D+01  0.137150D+02 -0.467359D+00
      2   0.415071D+01 -0.846807D+00  0.340551D+01 -0.152073D+02 -0.345850D+00
      3   0.101227D+00 -0.505644D+00 -0.812138D+00  0.149229D+01  0.813209D+00
      4   0.599110D+01  0.104831D+01  0.261202D+01  0.641157D+01  0.341528D+01
      5  -0.304095D+01  0.374761D+01 -0.232123D+01  0.227886D+02  0.496006D+01
      6   0.213167D+01 -0.372654D-01  0.369727D+01  0.384591D+01  0.476790D+01
                81            82            83            84            85 
      1   0.769137D+01 -0.599896D+00 -0.269899D+01 -0.329293D+00 -0.397611D+01
      2  -0.164693D+02  0.690079D+01  0.876055D+01  0.894642D+00  0.101940D+02
      3   0.877796D+01 -0.630089D+01 -0.606156D+01 -0.565349D+00 -0.621787D+01
      4   0.796632D+01  0.688663D+01  0.138435D+02  0.747271D+00  0.112288D+02
      5   0.263519D+02  0.155435D+01  0.227768D+01  0.181739D+01  0.191661D+01
      6   0.518600D+01  0.849775D+00  0.243815D+01  0.627022D+00  0.328917D+01
                86            87            88            89            90 
      1  -0.397799D+02 -0.346519D+01  0.372245D+00  0.265162D+01 -0.551040D+01
      2   0.734987D+02  0.323724D+01 -0.889635D+00 -0.769544D+01  0.471896D+01
      3  -0.337188D+02  0.227950D+00  0.517390D+00  0.504382D+01  0.791446D+00
      4   0.224755D+02  0.198509D+01 -0.151583D+01 -0.235697D+01  0.143375D+01
      5   0.299681D+01  0.183445D+01  0.958261D+00  0.191303D+01 -0.125893D+00
      6   0.140947D+02  0.875306D+01  0.360714D+00  0.829294D+01  0.158559D+01
                91            92            93            94            95 
      1  -0.107165D+01  0.101200D+01  0.354324D+01 -0.167563D+01 -0.572989D+01
      2  -0.359701D+01 -0.247095D+00  0.756082D-02  0.826671D+00  0.528389D+01
      3   0.466867D+01 -0.764903D+00 -0.355080D+01  0.848960D+00  0.446004D+00
      4  -0.186154D+01  0.298300D+01  0.306561D+01  0.551914D+00 -0.244887D-01
      5  -0.200583D+01  0.878940D+00  0.623483D+01 -0.312181D+00 -0.110716D+00
      6   0.234176D+01 -0.240270D+01 -0.480031D+01 -0.995483D+00  0.361892D+01
                96            97            98            99           100 
      1  -0.161725D+01  0.433586D+01 -0.818644D+01 -0.254601D+02  0.626707D+02
      2   0.361369D+01  0.106801D+01  0.295917D+01 -0.130481D+02 -0.288780D+02
      3  -0.199644D+01 -0.540388D+01  0.522727D+01  0.385081D+02 -0.337927D+02
      4  -0.118570D+00  0.345572D+01  0.328327D+00 -0.124777D+00 -0.327674D+02
      5  -0.473831D+00  0.501926D+01  0.675622D+00  0.214933D+01  0.181415D+02
      6   0.504207D+01 -0.262224D+01  0.121448D+02  0.292661D+02 -0.105783D+02
               101           102           103           104           105 
      1  -0.112617D+02  0.155247D+02 -0.535642D+00  0.501142D+01  0.892418D+00
      2   0.158654D+01 -0.776323D+01 -0.404036D+01  0.227937D+01 -0.247593D+00
      3   0.967511D+01 -0.776147D+01  0.457600D+01 -0.729079D+01 -0.644826D+00
      4   0.177783D+02 -0.100516D+02  0.130945D+02 -0.101133D+02 -0.233357D+00
      5  -0.592068D+01  0.111269D+02  0.302461D+01 -0.114604D+01 -0.254038D+00
      6   0.405149D+01 -0.572627D+01 -0.441315D+00  0.151548D+01  0.162370D+01
               106           107           108           109           110 
      1   0.310793D+02 -0.798050D+01  0.849327D+01  0.302513D+01 -0.101001D+02
      2  -0.171948D+02  0.427843D+01 -0.671831D+01  0.246452D+01  0.700726D+01
      3  -0.138845D+02  0.370208D+01 -0.177497D+01 -0.548964D+01  0.309284D+01
      4  -0.143329D+02  0.297230D+01 -0.348204D+01 -0.559357D+01  0.489295D+01
      5   0.982915D+01 -0.127432D+00  0.964124D+01  0.155305D+01 -0.251381D+01
      6  -0.394322D+01  0.126257D+01 -0.373508D+01  0.180997D+00  0.610431D+01
               111           112           113           114           115 
      1  -0.258975D+01 -0.323207D+01 -0.254694D+02 -0.103140D+02  0.148582D+01
      2   0.264268D+01 -0.218957D+01  0.427181D+02  0.130110D+02 -0.272413D+01
      3  -0.529316D-01  0.542164D+01 -0.172487D+02 -0.269696D+01  0.123831D+01
      4  -0.230694D+01  0.127450D+02 -0.314238D+02 -0.114856D+02  0.121326D+00
      5  -0.828323D+00  0.360870D+01 -0.137663D+02 -0.824171D+01  0.535089D-01
      6   0.335099D+01 -0.381067D+01  0.221929D+02  0.129749D+02  0.599547D+00
               116           117           118           119           120 
      1  -0.161610D+02 -0.940797D+01 -0.334978D+00 -0.126614D+01 -0.145713D+01
      2   0.205317D+02  0.721932D+01  0.254327D+00  0.384784D+00  0.173578D+00
      3  -0.437062D+01  0.218865D+01  0.806518D-01  0.881352D+00  0.128356D+01
      4  -0.120815D+02 -0.413734D+01  0.255971D+01  0.709288D+01  0.339002D+01
      5  -0.568611D+01 -0.477540D+01  0.908350D+00  0.440579D+01  0.535719D+01
      6   0.118321D+02  0.968051D+01  0.479965D+01  0.186613D+01  0.281219D+01
               121           122           123           124           125 
      1  -0.286263D+01 -0.178611D+02 -0.128634D+02 -0.620088D+00 -0.102617D+02
      2   0.160974D+01  0.145587D+02  0.542836D+01  0.533738D+00  0.242095D+01
      3   0.125289D+01  0.330243D+01  0.743501D+01  0.863497D-01  0.784076D+01
      4   0.623287D+01  0.500926D+01  0.276278D+01  0.848428D+00  0.212617D+01
      5   0.349348D+01  0.137700D+01  0.177992D+01  0.323387D+01  0.142199D+01
      6   0.205492D+01  0.222653D+02  0.188129D+02  0.248240D+01  0.162189D+02
               126           127           128           129           130 
      1  -0.147420D+02  0.117397D+02  0.391707D+01  0.681347D+01  0.607498D+01
      2  -0.109442D+01  0.109423D+02 -0.649145D+01 -0.128936D+02 -0.130002D+02
      3   0.158364D+02 -0.226820D+02  0.257438D+01  0.608014D+01  0.692520D+01
      4   0.324319D+01  0.744669D+01  0.647467D+00  0.381511D+01 -0.132056D+01
      5   0.122652D+01  0.592337D+01 -0.493740D+01 -0.206016D+02 -0.651160D+01
      6   0.162002D+02 -0.178180D+00  0.361353D+01  0.202973D+01  0.565828D+01
               131           132           133           134           135 
      1   0.929107D+01  0.265224D+01  0.655048D+01  0.550930D+01 -0.126139D+02
      2  -0.238961D+02  0.137112D+02 -0.118094D+02  0.540658D+01  0.125822D+02
      3   0.146050D+02 -0.163634D+02  0.525895D+01 -0.109159D+02  0.317203D-01
      4  -0.183918D+02  0.201560D+01  0.557398D+01  0.784491D-01  0.168928D+01
      5   0.446942D+01  0.100470D+02 -0.208284D+02  0.585300D+01  0.107848D+02
      6   0.213043D+02  0.872412D+00  0.995152D+00  0.485723D+01 -0.123856D+02
               136           137           138           139           140 
      1  -0.280189D+00  0.161650D+02  0.243219D+02  0.226732D+02  0.216455D+00
      2   0.275293D+01 -0.122616D+02 -0.120305D+02 -0.205199D+02 -0.144542D+02
      3  -0.247274D+01 -0.390340D+01 -0.122914D+02 -0.215335D+01  0.142378D+02
      4   0.149170D+02 -0.542784D+01  0.250817D+01 -0.121269D+02 -0.357498D+02
      5   0.258680D+02 -0.102993D+01 -0.137504D+02 -0.281990D+01 -0.412703D+01
      6   0.404581D+01 -0.664526D+00 -0.130626D+01 -0.185717D+01 -0.570188D+01
               141           142           143           144           145 
      1  -0.120300D+01  0.310286D+02 -0.180883D+01 -0.188961D+02  0.150500D+02
      2  -0.187937D+01 -0.151533D+02 -0.237484D+01  0.166847D+02  0.395712D+01
      3   0.308236D+01 -0.158753D+02  0.418367D+01  0.221138D+01 -0.190072D+02
      4  -0.353240D+01  0.389454D+01 -0.337685D+01  0.117810D+02 -0.305462D+02
      5   0.150463D+02 -0.205395D+02  0.136955D+02 -0.154802D+02 -0.394706D+01
      6   0.189107D+01 -0.195424D+01  0.268108D+01 -0.154868D+01  0.183753D+01
               146           147           148           149           150 
      1  -0.480640D+01 -0.187620D+01 -0.109672D+01 -0.432322D+01 -0.635323D+00
      2  -0.115075D+02  0.669034D-01 -0.120312D+02  0.224532D+02  0.299427D+01
      3   0.163139D+02  0.180930D+01  0.131279D+02 -0.181300D+02 -0.235895D+01
      4   0.278596D+02  0.375628D+01  0.236278D+02 -0.268147D+02 -0.347145D+01
      5   0.229113D+01  0.545165D+01  0.187460D+01 -0.269254D+01 -0.244172D+01
      6  -0.163841D+01 -0.303861D+01 -0.141941D+01  0.253064D+01  0.623213D+01
               151           152           153           154           155 
      1  -0.150197D+01 -0.648668D+00 -0.110541D+01  0.337556D+01  0.233200D+01
      2  -0.411684D-01  0.351858D+01  0.240418D+01 -0.126955D+02  0.118878D-01
      3   0.154314D+01 -0.286991D+01 -0.129876D+01  0.931990D+01 -0.234389D+01
      4   0.376954D+01 -0.386580D+01 -0.536908D+01 -0.468442D+01  0.436818D+01
      5   0.559541D+01 -0.432727D+01 -0.217352D+01  0.201264D+02 -0.499869D+01
      6  -0.398804D+01  0.783047D+01  0.107293D+01 -0.897893D+01  0.498497D+01
               156           157           158           159           160 
      1  -0.402417D+01 -0.116251D+01 -0.511852D+00  0.824942D+00 -0.288862D+01
      2  -0.124608D+02 -0.840310D+00 -0.113990D+01 -0.164509D+01 -0.109627D+02
      3   0.164850D+02  0.200282D+01  0.165175D+01  0.820148D+00  0.138514D+02
      4  -0.547770D+01  0.487406D+01 -0.139504D+01  0.258591D+01 -0.402638D+01
      5   0.191779D+02 -0.129419D+01  0.336772D+01 -0.713165D+00  0.169394D+02
      6  -0.962739D+01  0.289838D+01 -0.216392D+01  0.684104D+01 -0.670793D+01
               161           162           163           164           165 
      1   0.367685D+01 -0.111667D+02 -0.329539D+01 -0.769704D+01  0.856899D+01
      2   0.885889D+00 -0.164661D+02 -0.128821D+01  0.436390D+01  0.118765D+01
      3  -0.456274D+01  0.276328D+02  0.458360D+01  0.333314D+01 -0.975664D+01
      4   0.212541D+01 -0.377460D+01  0.837871D+01  0.815486D+01 -0.675763D+01
      5  -0.295923D+01  0.201905D+02 -0.114448D+02 -0.765013D+01  0.124830D+02
      6   0.749935D+01 -0.126378D+02 -0.980494D+01 -0.134854D+02  0.125700D+02
               166           167           168           169           170 
      1  -0.497452D+01 -0.102377D+02  0.917913D+01  0.386072D+01  0.754158D+01
      2   0.283201D+01  0.958733D+01 -0.163274D+01  0.663272D+00 -0.205749D+00
      3   0.214251D+01  0.650336D+00 -0.754639D+01 -0.452399D+01 -0.733583D+01
      4   0.740432D+01  0.603987D+01 -0.473257D+01 -0.443708D+01 -0.405901D+01
      5  -0.550678D+01 -0.683211D+01  0.522947D+01  0.871093D+01  0.474564D+01
      6  -0.865326D+01 -0.140109D+02  0.146933D+02  0.619809D+01  0.120483D+02
               171           172           173           174           175 
      1  -0.108799D+02 -0.468589D+01  0.842211D+00 -0.102857D+02 -0.103804D+01
      2  -0.329476D+01 -0.424540D+01 -0.640609D+00 -0.368971D+01  0.140989D+01
      3   0.141747D+02  0.893128D+01 -0.201602D+00  0.139754D+02 -0.371843D+00
      4   0.457380D+01 -0.919998D+01  0.406212D+00 -0.195901D+01  0.130748D+01
      5  -0.770613D+01  0.131527D+02  0.166844D+01  0.793287D+01  0.199055D+01
      6  -0.147053D+02  0.111080D+00  0.426478D+01 -0.544025D+01  0.226571D+01
               176           177           178           179           180 
      1  -0.296688D+01 -0.493156D+00 -0.629261D+01 -0.117609D+00 -0.632336D+01
      2   0.336076D+01 -0.280188D+01 -0.256274D+01 -0.113175D+01 -0.619432D+01
      3  -0.393879D+00  0.329503D+01  0.885535D+01  0.124936D+01  0.125177D+02
      4   0.110336D+01  0.161742D+00 -0.210381D+01  0.340712D+00 -0.320859D+01
      5   0.170707D+01 -0.181172D+01  0.946273D+01 -0.852376D-01  0.479041D+01
      6  -0.151045D+01  0.238509D+01 -0.232563D+01  0.246469D+01 -0.176716D+01
               181           182           183           184           185 
      1  -0.403796D+00  0.154242D+01 -0.570274D+00 -0.811397D+00 -0.206890D+02
      2   0.153164D+01  0.160020D+01  0.159607D+01  0.547091D+01  0.376517D+02
      3  -0.112784D+01 -0.314262D+01 -0.102579D+01 -0.465951D+01 -0.169628D+02
      4   0.430595D+01  0.812856D+01 -0.236551D+01  0.104220D+02  0.212780D+02
      5  -0.264196D+01 -0.329098D+01  0.510055D+01 -0.429566D+01 -0.590914D+01
      6  -0.309486D+01 -0.316922D+01  0.112719D+01 -0.600767D+01 -0.300209D+02
               186           187           188           189           190 
      1   0.804029D+01  0.387712D+00  0.203442D+01 -0.231397D+01  0.847123D+01
      2  -0.556711D+01  0.182212D+01  0.144310D+01  0.125654D+01 -0.170067D+02
      3  -0.247318D+01 -0.220983D+01 -0.347752D+01  0.105742D+01  0.853552D+01
      4  -0.526073D+01  0.991883D-01  0.558473D+00  0.215981D+01  0.249650D+01
      5   0.406888D+01  0.317710D+01  0.143224D+01 -0.196998D+01 -0.229897D+02
      6   0.136694D+02  0.118429D+01  0.650791D+01 -0.302302D+01 -0.295746D+00
               191           192           193           194           195 
      1  -0.214854D+01 -0.128323D+01 -0.327592D+01 -0.756243D+00 -0.165192D+01
      2   0.373410D+01  0.164491D+02  0.685100D+01 -0.934672D+00 -0.865512D+01
      3  -0.158556D+01 -0.151659D+02 -0.357508D+01  0.169091D+01  0.103070D+02
      4   0.366140D+01 -0.324509D+01  0.288708D+01 -0.659258D+00 -0.301110D+01
      5   0.276562D+01  0.245961D+02  0.842239D+01 -0.574859D+01 -0.960862D+01
      6  -0.517588D+01  0.193758D+01 -0.443210D+01  0.187205D+01  0.511212D+01
               196           197           198           199           200 
      1  -0.120910D+01 -0.436359D+00 -0.632823D+01  0.893877D+01 -0.434490D+01
      2   0.136429D+02 -0.368737D+01 -0.221294D+02 -0.800307D+01  0.325256D+01
      3  -0.124338D+02  0.412373D+01  0.284577D+02 -0.935692D+00  0.109234D+01
      4  -0.216187D+01 -0.265416D+01  0.164909D+01 -0.328169D+01  0.259915D+01
      5   0.201916D+02 -0.322055D+01 -0.261157D+02  0.876166D+01 -0.295388D+01
      6   0.547941D+00  0.525948D+01 -0.699746D+00 -0.442781D+00  0.499227D+00
               201           202           203           204           205 
      1   0.620200D+01 -0.999117D+01  0.987850D+00 -0.191267D+01  0.125951D+02
      2  -0.633303D+01  0.674066D+01 -0.302218D+00  0.364870D+01 -0.109231D+02
      3   0.131030D+00  0.325051D+01 -0.685633D+00 -0.173603D+01 -0.167204D+01
      4  -0.157509D+01  0.446050D+01 -0.194084D+01  0.623114D+01  0.281956D+00
      5   0.138035D+02 -0.499993D+01  0.604443D+01 -0.100785D+02  0.206728D+02
      6   0.525152D+00  0.889642D+00 -0.135877D+01  0.244107D+01  0.238820D+01
               206           207           208           209           210 
      1  -0.312638D+00  0.685973D+01  0.531723D+02 -0.903007D+01 -0.180013D+02
      2   0.345517D+01 -0.170833D+02 -0.290564D+02  0.565976D+01  0.102541D+02
      3  -0.314253D+01  0.102236D+02 -0.241159D+02  0.337031D+01  0.774716D+01
      4   0.783122D+01 -0.527886D+01 -0.263800D+01  0.810116D+01  0.113661D+01
      5  -0.722957D+01  0.334238D+02 -0.193834D+02  0.301769D+01  0.151356D+02
      6   0.287965D+01  0.325157D+01 -0.190760D+01 -0.377460D-01  0.165604D+01
               211           212           213           214           215 
      1  -0.190267D+02  0.716905D+01  0.466188D+01 -0.329343D+02  0.375476D+01
      2   0.112966D+02 -0.192837D+01 -0.265065D+01  0.191670D+02 -0.245587D+01
      3   0.773005D+01 -0.524068D+01 -0.201123D+01  0.137673D+02 -0.129889D+01
      4   0.107391D+02 -0.243336D+01 -0.409798D+01 -0.861426D+00 -0.647971D+01
      5   0.592965D+01 -0.396709D+01 -0.719483D+01  0.213214D+02 -0.488056D+01
      6  -0.695882D+00  0.140174D+01  0.125424D+01  0.161966D+01  0.115544D+01
               216           217           218           219           220 
      1   0.144422D+02  0.649063D+01  0.572951D+01 -0.124016D+01  0.972228D+01
      2  -0.119147D+02 -0.597344D-02 -0.552002D+00  0.995374D+00  0.428606D+01
      3  -0.252752D+01 -0.648466D+01 -0.517750D+01  0.244787D+00 -0.140083D+02
      4  -0.283935D+01  0.829675D+01  0.118180D+02  0.113502D+01  0.263440D+02
      5  -0.165619D+02 -0.774797D+00  0.176612D+01  0.305666D+01  0.403480D+01
      6  -0.130416D+01  0.849006D+00  0.868049D+00  0.242006D+00  0.327412D+01
               221           222           223           224           225 
      1  -0.450574D+01  0.283708D+00 -0.313426D+01 -0.257116D+00  0.112419D+01
      2   0.263128D+02  0.822800D+00  0.140230D+01  0.804311D+00  0.268451D+00
      3  -0.218071D+02 -0.110651D+01  0.173195D+01 -0.547195D+00 -0.139264D+01
      4   0.483009D+02  0.436616D+01  0.113839D+01  0.286794D+01  0.442978D+01
      5   0.455825D+01  0.637628D+01  0.632725D+01  0.437037D+01  0.296935D+01
      6   0.763668D+01  0.662847D+01  0.279120D+01  0.620154D+01  0.151991D+01
               226           227           228           229           230 
      1   0.162373D+02  0.115181D+02 -0.511311D+01  0.754330D+01  0.272338D+01
      2  -0.591585D+01 -0.295028D+01  0.127790D+01  0.219731D+00  0.615757D+01
      3  -0.103215D+02 -0.856787D+01  0.383521D+01 -0.776303D+01 -0.888095D+01
      4   0.194171D+02  0.224088D+02 -0.644115D+01  0.153112D+02  0.270899D+02
      5  -0.660262D+01 -0.327101D+01  0.766038D+01 -0.336321D+01 -0.667103D+01
      6  -0.493201D+01 -0.486461D+01  0.396982D+01 -0.468838D+01 -0.611879D+01
               231           232           233           234 
      1  -0.303662D+01 -0.976693D+01 -0.410612D+01  0.566305D+01
      2  -0.148351D+01  0.375584D+01 -0.200974D+01 -0.348611D+01
      3   0.452013D+01  0.601109D+01  0.611586D+01 -0.217695D+01
      4  -0.817329D+01 -0.118415D+02 -0.208932D+02  0.105812D+02
      5   0.317369D+01  0.100461D+02  0.756240D+01 -0.953557D+01
      6   0.628242D+01  0.581663D+01  0.833288D+01 -0.626384D+01
 End of Minotr F.D. properties file   788 does not exist.
 Leave Link 1002 at Fri Jul 16 13:48:25 2021, MaxMem=  5637144576 cpu:           16762.9 elap:            2109.0
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l601.exe)
 Copying SCF densities to generalized density rwf, IOpCl= 0 IROHF=0.

 **********************************************************************

            Population analysis using the SCF density.

 **********************************************************************

 Orbital symmetries:
       Occupied  (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A)
       Virtual   (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A)
 The electronic state is 1-A.
 Alpha  occ. eigenvalues --  -10.19384 -10.18915 -10.18668 -10.18591 -10.18404
 Alpha  occ. eigenvalues --  -10.18158 -10.17951 -10.17336 -10.16863 -10.16480
 Alpha  occ. eigenvalues --   -0.87882  -0.78277  -0.74893  -0.73168  -0.67854
 Alpha  occ. eigenvalues --   -0.65547  -0.61619  -0.59007  -0.54434  -0.49559
 Alpha  occ. eigenvalues --   -0.47827  -0.47793  -0.44803  -0.43504  -0.43014
 Alpha  occ. eigenvalues --   -0.40979  -0.39878  -0.39368  -0.38255  -0.37510
 Alpha  occ. eigenvalues --   -0.37039  -0.35489  -0.34227  -0.32229  -0.30434
 Alpha  occ. eigenvalues --   -0.29912  -0.28498  -0.24102
 Alpha virt. eigenvalues --    0.00835   0.01379   0.03476   0.03929   0.04138
 Alpha virt. eigenvalues --    0.06027   0.06546   0.06745   0.07690   0.08108
 Alpha virt. eigenvalues --    0.09085   0.09684   0.10728   0.11109   0.11955
 Alpha virt. eigenvalues --    0.11999   0.13092   0.13505   0.14231   0.14855
 Alpha virt. eigenvalues --    0.15443   0.15999   0.17035   0.17553   0.17822
 Alpha virt. eigenvalues --    0.18900   0.19466   0.19867   0.20934   0.21125
 Alpha virt. eigenvalues --    0.22686   0.22986   0.23783   0.24374   0.24853
 Alpha virt. eigenvalues --    0.25545   0.26312   0.26395   0.27175   0.28484
 Alpha virt. eigenvalues --    0.28833   0.29239   0.29801   0.30711   0.30877
 Alpha virt. eigenvalues --    0.31394   0.32070   0.32193   0.32935   0.33403
 Alpha virt. eigenvalues --    0.34041   0.34473   0.34614   0.35179   0.35924
 Alpha virt. eigenvalues --    0.36058   0.36290   0.36700   0.36909   0.37516
 Alpha virt. eigenvalues --    0.37989   0.38351   0.38898   0.39561   0.39730
 Alpha virt. eigenvalues --    0.39965   0.40571   0.40671   0.41117   0.41937
 Alpha virt. eigenvalues --    0.42211   0.42667   0.43366   0.44208   0.44802
 Alpha virt. eigenvalues --    0.44909   0.45496   0.46015   0.46287   0.47065
 Alpha virt. eigenvalues --    0.47591   0.48094   0.48821   0.48992   0.49152
 Alpha virt. eigenvalues --    0.50038   0.50221   0.50921   0.51808   0.52069
 Alpha virt. eigenvalues --    0.52691   0.52919   0.53179   0.54173   0.55029
 Alpha virt. eigenvalues --    0.55275   0.55811   0.56315   0.56739   0.57814
 Alpha virt. eigenvalues --    0.58513   0.58779   0.59297   0.59306   0.59844
 Alpha virt. eigenvalues --    0.60907   0.61642   0.61719   0.62751   0.63238
 Alpha virt. eigenvalues --    0.63477   0.64817   0.65626   0.66425   0.66979
 Alpha virt. eigenvalues --    0.67846   0.68382   0.69613   0.69685   0.70153
 Alpha virt. eigenvalues --    0.70649   0.72393   0.73416   0.73989   0.75876
 Alpha virt. eigenvalues --    0.76510   0.77181   0.79352   0.79437   0.80837
 Alpha virt. eigenvalues --    0.81021   0.82224   0.83430   0.84407   0.85635
 Alpha virt. eigenvalues --    0.87740   0.91118   0.93412   0.93912   0.94341
 Alpha virt. eigenvalues --    0.95874   0.96994   0.97201   0.99390   0.99637
 Alpha virt. eigenvalues --    1.00095   1.00371   1.00954   1.02419   1.03275
 Alpha virt. eigenvalues --    1.04358   1.04685   1.05635   1.06134   1.07395
 Alpha virt. eigenvalues --    1.08959   1.09546   1.11372   1.12538   1.13491
 Alpha virt. eigenvalues --    1.14693   1.15740   1.17663   1.18870   1.20066
 Alpha virt. eigenvalues --    1.21222   1.23525   1.24656   1.25798   1.28431
 Alpha virt. eigenvalues --    1.29642   1.32135   1.32939   1.34743   1.35333
 Alpha virt. eigenvalues --    1.36819   1.39857   1.41548   1.42438   1.43825
 Alpha virt. eigenvalues --    1.45715   1.47217   1.48680   1.50272   1.52023
 Alpha virt. eigenvalues --    1.52123   1.52918   1.56994   1.57741   1.60649
 Alpha virt. eigenvalues --    1.62796   1.64163   1.65457   1.67934   1.69696
 Alpha virt. eigenvalues --    1.71055   1.73319   1.73776   1.75795   1.76833
 Alpha virt. eigenvalues --    1.78412   1.80535   1.82969   1.83845   1.84778
 Alpha virt. eigenvalues --    1.85903   1.87654   1.89164   1.89670   1.91112
 Alpha virt. eigenvalues --    1.92450   1.94272   1.94825   1.96377   1.98166
 Alpha virt. eigenvalues --    1.98681   2.00740   2.01680   2.01935   2.04906
 Alpha virt. eigenvalues --    2.05662   2.06592   2.07472   2.08452   2.10803
 Alpha virt. eigenvalues --    2.12203   2.12831   2.14063   2.16278   2.16771
 Alpha virt. eigenvalues --    2.17987   2.19946   2.21113   2.21234   2.22292
 Alpha virt. eigenvalues --    2.26602   2.27294   2.29546   2.30565   2.31002
 Alpha virt. eigenvalues --    2.32523   2.33402   2.35560   2.37606   2.38269
 Alpha virt. eigenvalues --    2.38617   2.39366   2.41601   2.43746   2.44175
 Alpha virt. eigenvalues --    2.46353   2.50698   2.51879   2.53955   2.54365
 Alpha virt. eigenvalues --    2.57239   2.59355   2.60457   2.62279   2.63992
 Alpha virt. eigenvalues --    2.65067   2.66958   2.68705   2.70070   2.71098
 Alpha virt. eigenvalues --    2.73786   2.75135   2.78474   2.80590   2.84933
 Alpha virt. eigenvalues --    2.89461   2.95338   2.98640   2.99339   3.00303
 Alpha virt. eigenvalues --    3.01387   3.04348   3.07498   3.10020   3.12271
 Alpha virt. eigenvalues --    3.15149   3.16587   3.17284   3.18751   3.18987
 Alpha virt. eigenvalues --    3.22542   3.24473   3.29809   3.34204   3.40370
          Condensed to atoms (all electrons):
               1          2          3          4          5          6
     1  C    6.164339   0.254336  -0.403315  -0.792627  -0.029653  -0.174570
     2  C    0.254336   4.816473   0.209283   0.029013  -0.066951   0.047464
     3  C   -0.403315   0.209283   8.307119  -0.519148  -0.183133  -0.145535
     4  C   -0.792627   0.029013  -0.519148   8.627045  -0.806601   0.060342
     5  C   -0.029653  -0.066951  -0.183133  -0.806601   8.175676  -1.739601
     6  C   -0.174570   0.047464  -0.145535   0.060342  -1.739601  16.902502
     7  C    0.277776   0.154389  -0.141593   0.011190   1.135192  -2.020930
     8  C   -0.275866  -0.114551  -0.126931   0.120080  -0.748516   0.548377
     9  H   -0.392851  -0.027598   0.344811  -0.120983   0.101968  -0.016548
    10  H   -0.097168   0.044057   0.059003   0.005660  -0.010020   0.119433
    11  H    0.051584   0.299078  -0.062676   0.005584  -0.054188   0.053994
    12  H    0.005909  -0.010494   0.174672  -0.177910   0.067731  -0.013278
    13  H    0.035751   0.000526  -0.007751   0.250757  -0.058373   0.037050
    14  H    0.110867   0.003783  -0.332147  -0.373707  -0.342465  -1.044463
    15  C   -0.017670  -0.210101  -0.171136  -0.003862   0.147486  -2.952036
    16  C    0.010142   0.053045  -0.013284  -0.001838  -0.060272  -0.516924
    17  H    0.011370  -0.416526   0.074774  -0.005184   0.024268  -0.752837
    18  H    0.005222   0.106199   0.044996  -0.006314   0.224355  -0.192501
    19  H   -0.033344  -0.185950  -0.145413   0.017181  -0.159979   0.287722
    20  H    0.026589   0.001907   0.020723  -0.034161  -0.123098   0.058580
    21  H   -0.005188   0.012662   0.015264   0.009478   0.015439   0.269227
    22  H   -0.000956  -0.011846  -0.010340   0.000373   0.031553   0.205396
    23  H    0.001089  -0.001925  -0.007294  -0.000381  -0.078926   0.504148
    24  H    0.000588   0.002057   0.001881  -0.000398   0.011938   0.244560
    25  H    0.000167  -0.002555   0.005606  -0.001587   0.023697   0.169529
    26  H    0.313203   0.034059  -0.061408  -0.031289   0.003123  -0.090256
               7          8          9         10         11         12
     1  C    0.277776  -0.275866  -0.392851  -0.097168   0.051584   0.005909
     2  C    0.154389  -0.114551  -0.027598   0.044057   0.299078  -0.010494
     3  C   -0.141593  -0.126931   0.344811   0.059003  -0.062676   0.174672
     4  C    0.011190   0.120080  -0.120983   0.005660   0.005584  -0.177910
     5  C    1.135192  -0.748516   0.101968  -0.010020  -0.054188   0.067731
     6  C   -2.020930   0.548377  -0.016548   0.119433   0.053994  -0.013278
     7  C    7.447447  -0.684848   0.005352   0.076598  -0.142146   0.003610
     8  C   -0.684848   5.851147   0.002204   0.017810   0.043113  -0.009111
     9  H    0.005352   0.002204   1.501304   0.128125  -0.151949   0.037603
    10  H    0.076598   0.017810   0.128125   1.394554  -0.236737  -0.000597
    11  H   -0.142146   0.043113  -0.151949  -0.236737   1.102380  -0.001570
    12  H    0.003610  -0.009111   0.037603  -0.000597  -0.001570   0.954159
    13  H    0.002020  -0.003940  -0.011658  -0.000304   0.000525  -0.049492
    14  H    0.096673  -0.202822  -0.000525  -0.002688  -0.002263   0.028583
    15  C    0.178812   0.139410  -0.007040   0.000095  -0.030641   0.007185
    16  C   -0.136970  -0.022705   0.002080   0.001247   0.003055   0.000606
    17  H   -0.168482   0.040715   0.002646  -0.036052  -0.056898   0.000025
    18  H    0.111586  -0.288106  -0.000789  -0.006732  -0.000006  -0.000041
    19  H   -0.110755   0.134562   0.003090   0.018170   0.001352  -0.000062
    20  H   -0.082355   0.034007  -0.008277  -0.003094   0.013184  -0.000305
    21  H    0.018276  -0.012639  -0.004709  -0.000508   0.002827   0.000183
    22  H    0.052229  -0.014828   0.001950  -0.001181  -0.011324   0.000582
    23  H   -0.107805   0.001801   0.000001  -0.000161   0.000416   0.000028
    24  H    0.011270  -0.005146   0.000022  -0.000549  -0.001579   0.000010
    25  H    0.042293  -0.008761   0.000045  -0.000174  -0.000482   0.000035
    26  H    0.004150  -0.033180  -0.273523  -0.170696   0.027320   0.008605
              13         14         15         16         17         18
     1  C    0.035751   0.110867  -0.017670   0.010142   0.011370   0.005222
     2  C    0.000526   0.003783  -0.210101   0.053045  -0.416526   0.106199
     3  C   -0.007751  -0.332147  -0.171136  -0.013284   0.074774   0.044996
     4  C    0.250757  -0.373707  -0.003862  -0.001838  -0.005184  -0.006314
     5  C   -0.058373  -0.342465   0.147486  -0.060272   0.024268   0.224355
     6  C    0.037050  -1.044463  -2.952036  -0.516924  -0.752837  -0.192501
     7  C    0.002020   0.096673   0.178812  -0.136970  -0.168482   0.111586
     8  C   -0.003940  -0.202822   0.139410  -0.022705   0.040715  -0.288106
     9  H   -0.011658  -0.000525  -0.007040   0.002080   0.002646  -0.000789
    10  H   -0.000304  -0.002688   0.000095   0.001247  -0.036052  -0.006732
    11  H    0.000525  -0.002263  -0.030641   0.003055  -0.056898  -0.000006
    12  H   -0.049492   0.028583   0.007185   0.000606   0.000025  -0.000041
    13  H    0.787328  -0.076580  -0.009405  -0.001690  -0.000239  -0.000075
    14  H   -0.076580   3.551807   0.288819  -0.184789   0.065523  -0.109952
    15  C   -0.009405   0.288819   7.217572  -0.578550   0.285962  -0.009114
    16  C   -0.001690  -0.184789  -0.578550   5.876254  -0.158761   0.005559
    17  H   -0.000239   0.065523   0.285962  -0.158761   2.996157  -0.160029
    18  H   -0.000075  -0.109952  -0.009114   0.005559  -0.160029   2.793535
    19  H   -0.002076   0.105466  -0.000659  -0.005831   0.123975  -1.170882
    20  H   -0.002175   0.020310   0.273563   0.027564   0.021890  -0.002016
    21  H   -0.003606   0.022758  -0.193603   0.016672  -0.002740  -0.000408
    22  H   -0.000096   0.001306  -0.108840   0.007647   0.027358  -0.001817
    23  H   -0.000107  -0.034726   0.000019   0.159230  -0.032202  -0.017735
    24  H    0.000024   0.006252   0.033065  -0.180105   0.019963   0.004966
    25  H   -0.000052   0.040783   0.046243  -0.224953   0.009233   0.006223
    26  H    0.000879  -0.001096   0.001932   0.001079  -0.005916   0.009771
              19         20         21         22         23         24
     1  C   -0.033344   0.026589  -0.005188  -0.000956   0.001089   0.000588
     2  C   -0.185950   0.001907   0.012662  -0.011846  -0.001925   0.002057
     3  C   -0.145413   0.020723   0.015264  -0.010340  -0.007294   0.001881
     4  C    0.017181  -0.034161   0.009478   0.000373  -0.000381  -0.000398
     5  C   -0.159979  -0.123098   0.015439   0.031553  -0.078926   0.011938
     6  C    0.287722   0.058580   0.269227   0.205396   0.504148   0.244560
     7  C   -0.110755  -0.082355   0.018276   0.052229  -0.107805   0.011270
     8  C    0.134562   0.034007  -0.012639  -0.014828   0.001801  -0.005146
     9  H    0.003090  -0.008277  -0.004709   0.001950   0.000001   0.000022
    10  H    0.018170  -0.003094  -0.000508  -0.001181  -0.000161  -0.000549
    11  H    0.001352   0.013184   0.002827  -0.011324   0.000416  -0.001579
    12  H   -0.000062  -0.000305   0.000183   0.000582   0.000028   0.000010
    13  H   -0.002076  -0.002175  -0.003606  -0.000096  -0.000107   0.000024
    14  H    0.105466   0.020310   0.022758   0.001306  -0.034726   0.006252
    15  C   -0.000659   0.273563  -0.193603  -0.108840   0.000019   0.033065
    16  C   -0.005831   0.027564   0.016672   0.007647   0.159230  -0.180105
    17  H    0.123975   0.021890  -0.002740   0.027358  -0.032202   0.019963
    18  H   -1.170882  -0.002016  -0.000408  -0.001817  -0.017735   0.004966
    19  H    2.736280   0.005752  -0.000973  -0.000212   0.006287   0.001813
    20  H    0.005752   1.274936  -0.104536  -0.186048  -0.006215   0.005933
    21  H   -0.000973  -0.104536   0.920872  -0.049445  -0.001664  -0.012164
    22  H   -0.000212  -0.186048  -0.049445   0.937623   0.003009  -0.001105
    23  H    0.006287  -0.006215  -0.001664   0.003009   1.119787  -0.090542
    24  H    0.001813   0.005933  -0.012164  -0.001105  -0.090542   0.836950
    25  H    0.001854   0.009168   0.006938  -0.013360  -0.123009  -0.040966
    26  H   -0.039883   0.000893   0.001023   0.001855   0.000464  -0.000066
              25         26
     1  C    0.000167   0.313203
     2  C   -0.002555   0.034059
     3  C    0.005606  -0.061408
     4  C   -0.001587  -0.031289
     5  C    0.023697   0.003123
     6  C    0.169529  -0.090256
     7  C    0.042293   0.004150
     8  C   -0.008761  -0.033180
     9  H    0.000045  -0.273523
    10  H   -0.000174  -0.170696
    11  H   -0.000482   0.027320
    12  H    0.000035   0.008605
    13  H   -0.000052   0.000879
    14  H    0.040783  -0.001096
    15  C    0.046243   0.001932
    16  C   -0.224953   0.001079
    17  H    0.009233  -0.005916
    18  H    0.006223   0.009771
    19  H    0.001854  -0.039883
    20  H    0.009168   0.000893
    21  H    0.006938   0.001023
    22  H   -0.013360   0.001855
    23  H   -0.123009   0.000464
    24  H   -0.040966  -0.000066
    25  H    0.908714  -0.000071
    26  H   -0.000071   1.203741
 Mulliken charges:
               1
     1  C    0.954278
     2  C    0.980167
     3  C   -0.927027
     4  C   -0.260711
     5  C    0.499351
     6  C   -3.848844
     7  C   -0.032976
     8  C    1.618725
     9  H   -0.114751
    10  H   -0.298092
    11  H    0.148047
    12  H   -0.026667
    13  H    0.112759
    14  H   -0.634706
    15  C    1.672493
    16  C    1.922491
    17  H   -0.907993
    18  H   -0.345892
    19  H   -0.587484
    20  H   -0.242718
    21  H    0.080564
    22  H    0.140516
    23  H   -0.293585
    24  H    0.151327
    25  H    0.145444
    26  H    0.095286
 Sum of Mulliken charges =  -0.00000
 Mulliken charges with hydrogens summed into heavy atoms:
               1
     1  C    0.934813
     2  C    0.830121
     3  C   -0.927027
     4  C   -0.174620
     5  C   -0.135355
     6  C   -3.848844
     7  C   -0.940968
     8  C    0.685348
    15  C    1.650855
    16  C    1.925677
 Electronic spatial extent (au):  <R**2>=           1339.2645
 Charge=             -0.0000 electrons
 Dipole moment (field-independent basis, Debye):
    X=             -0.4295    Y=              0.5763    Z=              0.1093  Tot=              0.7270
 Quadrupole moment (field-independent basis, Debye-Ang):
   XX=            -64.9531   YY=            -64.2861   ZZ=            -65.0949
   XY=              1.0196   XZ=              1.1603   YZ=              0.4811
 Traceless Quadrupole moment (field-independent basis, Debye-Ang):
   XX=             -0.1751   YY=              0.4920   ZZ=             -0.3169
   XY=              1.0196   XZ=              1.1603   YZ=              0.4811
 Octapole moment (field-independent basis, Debye-Ang**2):
  XXX=              0.1572  YYY=             -0.0345  ZZZ=              0.6395  XYY=             -0.0876
  XXY=              3.2777  XXZ=              4.1888  XZZ=             -2.5961  YZZ=              1.9380
  YYZ=             -2.8171  XYZ=             -1.0393
 Hexadecapole moment (field-independent basis, Debye-Ang**3):
 XXXX=           -939.2712 YYYY=           -549.7544 ZZZZ=           -424.0678 XXXY=             -3.3645
 XXXZ=             11.0823 YYYX=              4.7213 YYYZ=              5.3662 ZZZX=              7.3629
 ZZZY=              2.5531 XXYY=           -248.1166 XXZZ=           -225.3787 YYZZ=           -166.8999
 XXYZ=             -4.0665 YYXZ=             -3.7079 ZZXY=              1.7628
 N-N= 5.709563421127D+02 E-N=-2.042836837037D+03  KE= 3.856316781933D+02
 No NMR shielding tensors so no spin-rotation constants.
 Leave Link  601 at Fri Jul 16 13:48:26 2021, MaxMem=  5637144576 cpu:               7.1 elap:               1.3
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l716.exe)
 Electric field and nuclear coordinate derivatives read from checkpoint file.
 Rotating derivatives to standard orientation.
 Dipole        =-1.68839324D-01 2.26576814D-01 4.73897661D-02
 Polarizability= 1.22600674D+02-6.80291573D+00 1.14486480D+02
                 7.23190235D-01 1.13236103D+00 9.98872265D+01
 Translational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 2      0.0000    0.0000       -0.0000    0.0000       -0.0000    0.0000
 3     -0.0000    0.0000        0.0000    0.0000        0.0000    0.0000
 4     -0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 5     -0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 6     -0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 Translational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000       -0.1933   -0.1934       -3.9318   -3.9304
 2      0.1933    0.1934       -0.5600   -0.5599       -4.3284   -4.3253
 3      3.9318    3.9304       12.1983   12.1939        0.5593    0.5599
 4      0.5600    0.5599        0.0000    0.0000        3.9310    3.9304
 5     -7.8699   -7.8685       -3.9310   -3.9304       -0.1935   -0.1934
 6     -0.5593   -0.5599        0.1935    0.1934       -0.0000    0.0000
 Translational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000        0.5802    0.5802      -11.7912  -11.7912
 2      1.6797    1.6797        0.0000    0.0000      -11.7912  -11.7912
 3      1.6797    1.6797        0.5802    0.5802        0.0000    0.0000
 4      0.5802    0.5802       -1.6797   -1.6797      -12.9760  -12.9760
 5     11.7912   11.7912       36.5816   36.5816        1.6797    1.6797
 6    -23.6056  -23.6056      -11.7912  -11.7912       -0.5802   -0.5802
 Rotational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0386    0.0000        0.7399    0.7736       15.8640   15.7216
 2     -0.8773   -0.7736        2.2332    2.2396       17.3311   17.3013
 3    -15.8688  -15.7216      -48.7407  -48.7754       -2.3881   -2.2396
 4     -2.2570   -2.2396       -0.0057    0.0000      -15.6413  -15.7216
 5     31.4896   31.4741       15.7797   15.7216        0.7917    0.7736
 6      2.4040    2.2396       -0.7554   -0.7736        0.0534    0.0000
 Rotational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0284    0.0000       13.2228   13.1897       -4.7987   -4.7499
 2    -13.3623  -13.1897      -17.4238  -17.4750        3.4797    3.6703
 3      4.8755    4.7499      -21.7722  -22.0272       17.4733   17.4750
 4     17.4067   17.4750        0.0551    0.0000        4.7934    4.7499
 5     18.8327   18.3569       -4.4980   -4.7499       13.1629   13.1897
 6    -17.3606  -17.4750      -13.2951  -13.1897        0.0894    0.0000
 Rotational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     53.8479   53.7125       75.3703   75.4622       11.5051   11.3420
 2     82.1750   82.0888       71.3831   71.3377       11.3925   11.3420
 3     82.1536   82.0888       75.4637   75.4622       14.0323   13.9312
 4      4.0391    4.1245      -28.4185  -28.3763        5.2750    5.4309
 5      2.7215    2.5892      -30.9227  -31.2504       28.2991   28.3763
 6     26.1943   25.8194       -2.4459   -2.5892       -4.2908   -4.1245
 Full mass-weighted force constant matrix:
 Low frequencies ---   -9.2943   -3.9471   -0.0006   -0.0005   -0.0004    4.7830
 Low frequencies ---  106.9149  166.5864  191.0365
 Diagonal vibrational polarizability:
        1.9906344       1.4717352       2.5217771
 Harmonic frequencies (cm**-1), IR intensities (KM/Mole), Raman scattering
 activities (A**4/AMU), depolarization ratios for plane and unpolarized
 incident light, reduced masses (AMU), force constants (mDyne/A),
 Raman invariants Alpha2 = alpha**2, Beta2 = beta(alpha)**2 (A**4/AMU)
 ROA invariants AlphaG = alphaG', Gamma2 = beta(G')**2, Delta2 = beta(A)**2, (10**4 A**5/AMU)
 Far-From-Resonance Raman intensities (K), ROA intensites (10**4 K), CID=(ROA/Raman)*10**4
    Raman1;ROA1;CID1 =ICPu/SCPu(180), Raman2;ROA2;CID2 =ICPd/SCPd(90)
    Raman3;ROA3;CID3 =DCPI(180) RC180 = degree of circularity
 and normal coordinates:
 Incident light (cm**-1):   20491.80
                      1                      2                      3
                      A                      A                      A
 Frequencies --    106.9137               166.5857               191.0343
 Red. masses --      2.6288                 1.8473                 1.3437
 Frc consts  --      0.0177                 0.0302                 0.0289
 IR Inten    --      0.0287                 0.1411                 0.0704
 RamAct Fr= 1--      3.5458                 1.1840                 0.6299
  Dep-P Fr= 1--      0.7366                 0.6562                 0.7275
  Dep-U Fr= 1--      0.8483                 0.7924                 0.8422
 Alpha2 Fr= 1--      0.0008                 0.0020                 0.0002
 Beta2  Fr= 1--      0.5013                 0.1564                 0.0884
 AlphaG Fr= 1--      0.0006                -0.0063                 0.0009
 Gamma2 Fr= 1--      0.9606                -0.3476                -0.1275
 Delta2 Fr= 1--     -0.2215                -0.1134                 0.0254
 Raman1 Fr= 1--      14.183                  4.736                  2.520
 ROA1   Fr= 1--      85.131                -36.994                -11.428
 CID1   Fr= 1--       6.002                 -7.812                 -4.535
 Raman2 Fr= 1--       6.016                  1.876                  1.061
 ROA2   Fr= 1--      24.827                 -7.435                 -3.264
 CID2   Fr= 1--       4.127                 -3.962                 -3.076
 Raman3 Fr= 1--      12.032                  3.753                  2.122
 ROA3   Fr= 1--      85.131                -36.994                -11.428
 CID3   Fr= 1--       7.075                 -9.858                 -5.385
 RC180  Fr= 1--       0.697                  0.585                  0.684
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.04   0.08  -0.17    -0.03  -0.06   0.12     0.01   0.02  -0.03
     2   6     0.03  -0.02   0.02    -0.02   0.06  -0.05     0.01   0.01  -0.01
     3   6    -0.01   0.03  -0.01    -0.03  -0.01  -0.00     0.01   0.00   0.02
     4   6    -0.12  -0.07   0.24    -0.10  -0.06   0.02     0.05   0.04  -0.01
     5   6     0.01   0.05  -0.05    -0.00   0.05  -0.05    -0.01  -0.03   0.03
     6   6     0.02  -0.02  -0.02     0.03   0.02  -0.01    -0.02  -0.01   0.01
     7   6     0.00  -0.00   0.05    -0.02   0.03  -0.03     0.01  -0.01   0.00
     8   6    -0.04   0.07   0.02    -0.01   0.05  -0.02     0.01  -0.04   0.00
     9   1     0.22   0.19  -0.29    -0.21  -0.17   0.23     0.04   0.06  -0.05
    10   1    -0.02   0.01   0.11     0.04   0.03  -0.20    -0.00   0.01  -0.01
    11   1     0.12  -0.14   0.02    -0.06   0.23  -0.04     0.02   0.01  -0.01
    12   1    -0.17  -0.09   0.33    -0.14  -0.15   0.10     0.07   0.09  -0.05
    13   1    -0.18  -0.12   0.36    -0.12  -0.02  -0.05     0.08   0.02   0.01
    14   1     0.01   0.07  -0.08    -0.01   0.06  -0.06     0.00  -0.05   0.05
    15   6     0.06  -0.10  -0.06     0.14   0.00  -0.04    -0.03  -0.08  -0.02
    16   6     0.02  -0.01  -0.01     0.03  -0.06   0.04    -0.04   0.09   0.01
    17   1    -0.00  -0.02   0.11    -0.03   0.01  -0.02     0.02  -0.00  -0.02
    18   1    -0.07   0.07   0.05    -0.00   0.05  -0.03     0.01  -0.04   0.01
    19   1    -0.08   0.11   0.00    -0.01   0.07  -0.00     0.01  -0.06  -0.01
    20   1     0.04  -0.07  -0.04     0.05   0.30   0.05    -0.15   0.19   0.15
    21   1     0.13  -0.11  -0.15     0.50  -0.04  -0.12     0.33  -0.13  -0.19
    22   1     0.02  -0.20  -0.04    -0.05  -0.29  -0.06    -0.27  -0.41  -0.08
    23   1    -0.01   0.04   0.02     0.02  -0.16   0.00     0.10  -0.15  -0.12
    24   1     0.03  -0.06   0.03     0.03  -0.00   0.01    -0.02   0.44  -0.14
    25   1     0.03  -0.01  -0.07     0.06  -0.07   0.15    -0.24   0.10   0.32
    26   1    -0.17   0.09  -0.32     0.16  -0.09   0.25    -0.03   0.01  -0.06
                      4                      5                      6
                      A                      A                      A
 Frequencies --    210.9931               231.2244               297.7815
 Red. masses --      1.8294                 1.2403                 1.8681
 Frc consts  --      0.0480                 0.0391                 0.0976
 IR Inten    --      0.0066                 0.0742                 0.0695
 RamAct Fr= 1--      0.2922                 0.2979                 0.3422
  Dep-P Fr= 1--      0.5998                 0.5975                 0.5534
  Dep-U Fr= 1--      0.7498                 0.7480                 0.7125
 Alpha2 Fr= 1--      0.0008                 0.0008                 0.0013
 Beta2  Fr= 1--      0.0365                 0.0371                 0.0406
 AlphaG Fr= 1--      0.0004                 0.0093                -0.0076
 Gamma2 Fr= 1--     -0.2736                 0.1482                -0.0052
 Delta2 Fr= 1--     -0.2393                -0.1166                 0.1729
 Raman1 Fr= 1--       1.169                  1.192                  1.369
 ROA1   Fr= 1--     -33.928                 10.496                  5.037
 CID1   Fr= 1--     -29.026                  8.807                  3.680
 Raman2 Fr= 1--       0.438                  0.446                  0.488
 ROA2   Fr= 1--      -4.653                  4.490                 -1.507
 CID2   Fr= 1--     -10.618                 10.074                 -3.090
 Raman3 Fr= 1--       0.876                  0.891                  0.975
 ROA3   Fr= 1--     -33.928                 10.496                  5.037
 CID3   Fr= 1--     -38.711                 11.774                  5.164
 RC180  Fr= 1--       0.500                  0.496                  0.425
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.03   0.00   0.05    -0.03  -0.00   0.03    -0.05  -0.01  -0.02
     2   6    -0.04   0.03  -0.03    -0.04  -0.03   0.03    -0.07  -0.12   0.13
     3   6    -0.01   0.00   0.02    -0.00   0.01  -0.02    -0.01  -0.03   0.00
     4   6     0.04   0.04   0.05    -0.00   0.00   0.03     0.02  -0.00  -0.01
     5   6    -0.00  -0.04  -0.02     0.01   0.00  -0.05    -0.00  -0.01  -0.02
     6   6     0.00  -0.01  -0.02     0.02  -0.02  -0.03    -0.01   0.04  -0.04
     7   6     0.01  -0.01  -0.05    -0.01  -0.02  -0.02     0.01   0.02  -0.06
     8   6     0.02  -0.05  -0.04     0.01   0.01  -0.02     0.07  -0.01  -0.04
     9   1    -0.10  -0.02   0.09    -0.04  -0.02   0.03     0.10   0.06  -0.13
    10   1    -0.03   0.02  -0.05    -0.04  -0.02   0.10    -0.05  -0.08   0.44
    11   1    -0.08   0.06  -0.03    -0.08  -0.09   0.02    -0.15  -0.40   0.08
    12   1     0.02   0.09   0.08    -0.03   0.01   0.09     0.02   0.03  -0.00
    13   1     0.10   0.02   0.05     0.02   0.00   0.02     0.06  -0.01  -0.02
    14   1     0.03  -0.06   0.00     0.03   0.02  -0.07    -0.02  -0.02  -0.02
    15   6     0.08  -0.10  -0.07     0.07   0.01  -0.02     0.06   0.13  -0.01
    16   6    -0.07   0.14   0.09    -0.02   0.02   0.04    -0.03  -0.01   0.05
    17   1    -0.01  -0.03  -0.09    -0.03  -0.04  -0.02     0.02   0.05  -0.12
    18   1     0.02  -0.06  -0.05     0.00   0.03  -0.02     0.08   0.01  -0.06
    19   1     0.03  -0.07  -0.05     0.00   0.03  -0.01     0.10  -0.05  -0.04
    20   1     0.14  -0.23  -0.16     0.18  -0.24  -0.20    -0.02   0.40   0.06
    21   1    -0.03  -0.08  -0.13    -0.24   0.05   0.08     0.37   0.09   0.00
    22   1     0.19  -0.09   0.04     0.29   0.26   0.06    -0.10  -0.05  -0.07
    23   1    -0.25   0.50   0.28     0.10  -0.31  -0.12    -0.13   0.06   0.10
    24   1     0.07  -0.10   0.37     0.02   0.43  -0.13     0.01  -0.11   0.15
    25   1    -0.11   0.16  -0.28    -0.21   0.02   0.45     0.03  -0.01  -0.02
    26   1     0.03  -0.01   0.09    -0.03   0.03   0.05    -0.23   0.06  -0.11
                      7                      8                      9
                      A                      A                      A
 Frequencies --    359.1272               385.1849               394.2225
 Red. masses --      2.2799                 2.4473                 2.3202
 Frc consts  --      0.1732                 0.2139                 0.2125
 IR Inten    --      1.0175                 0.1708                 0.8245
 RamAct Fr= 1--      2.6326                 1.6110                 0.8686
  Dep-P Fr= 1--      0.4672                 0.5286                 0.6751
  Dep-U Fr= 1--      0.6368                 0.6916                 0.8060
 Alpha2 Fr= 1--      0.0150                 0.0069                 0.0012
 Beta2  Fr= 1--      0.2794                 0.1857                 0.1167
 AlphaG Fr= 1--      0.0123                 0.0042                 0.0055
 Gamma2 Fr= 1--      1.2059                -0.2950                -0.4975
 Delta2 Fr= 1--      0.4768                -0.0452                -0.2988
 Raman1 Fr= 1--      10.531                  6.444                  3.474
 ROA1   Fr= 1--     131.023                -29.763                -57.316
 CID1   Fr= 1--      12.442                 -4.619                -16.497
 Raman2 Fr= 1--       3.353                  2.228                  1.400
 ROA2   Fr= 1--      25.127                 -6.717                 -9.549
 CID2   Fr= 1--       7.494                 -3.015                 -6.820
 Raman3 Fr= 1--       6.706                  4.456                  2.800
 ROA3   Fr= 1--     131.023                -29.763                -57.316
 CID3   Fr= 1--      19.538                 -6.679                -20.467
 RC180  Fr= 1--       0.274                  0.383                  0.612
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02  -0.09   0.00     0.08   0.04   0.04     0.03   0.09   0.04
     2   6     0.04  -0.06  -0.03     0.06   0.01   0.01    -0.07  -0.02   0.01
     3   6     0.04  -0.03  -0.10     0.03   0.06   0.02     0.10   0.09  -0.03
     4   6     0.13   0.04   0.10    -0.03   0.01  -0.01    -0.11  -0.07  -0.05
     5   6     0.02   0.03  -0.13     0.03   0.05  -0.01     0.11   0.01  -0.04
     6   6     0.01  -0.04  -0.05    -0.03   0.04  -0.04     0.09  -0.09  -0.01
     7   6    -0.01  -0.05   0.04     0.06   0.06  -0.07    -0.01  -0.10  -0.01
     8   6    -0.09   0.08   0.01     0.05   0.01  -0.06    -0.04  -0.04  -0.04
     9   1    -0.08  -0.21   0.06     0.05   0.01   0.06    -0.01   0.08   0.08
    10   1     0.04  -0.08  -0.13     0.06   0.02   0.11    -0.16   0.01   0.05
    11   1     0.09   0.04  -0.02    -0.01  -0.09  -0.01    -0.10  -0.07  -0.00
    12   1     0.03   0.23   0.29    -0.02  -0.08  -0.05    -0.10  -0.37  -0.05
    13   1     0.37  -0.05   0.13    -0.13   0.04  -0.02    -0.37   0.04  -0.11
    14   1     0.01   0.09  -0.20     0.09   0.03   0.00     0.21  -0.01  -0.04
    15   6    -0.08   0.07   0.01    -0.15  -0.06  -0.07    -0.06   0.02   0.07
    16   6    -0.05   0.01   0.05    -0.07  -0.14   0.17     0.04   0.09   0.03
    17   1    -0.01  -0.07   0.16     0.11   0.12  -0.11    -0.08  -0.19   0.03
    18   1    -0.14   0.06   0.07     0.01  -0.03  -0.02    -0.06  -0.12  -0.00
    19   1    -0.17   0.18  -0.01     0.04  -0.02  -0.13    -0.11   0.03  -0.06
    20   1    -0.16   0.23   0.15    -0.17  -0.21   0.05    -0.14   0.13   0.24
    21   1     0.02   0.06   0.14    -0.27  -0.04  -0.21    -0.00   0.01   0.18
    22   1    -0.23   0.10  -0.15    -0.18  -0.07  -0.10    -0.22   0.08  -0.12
    23   1    -0.16   0.06   0.10    -0.32  -0.30   0.16     0.02   0.22   0.09
    24   1     0.05   0.01   0.16     0.02  -0.17   0.28     0.17   0.16   0.13
    25   1    -0.10   0.01   0.03     0.08  -0.16   0.35    -0.15   0.11  -0.06
    26   1     0.15  -0.07   0.12     0.12   0.05   0.07     0.04   0.17   0.11
                     10                     11                     12
                      A                      A                      A
 Frequencies --    420.0343               456.1624               480.2945
 Red. masses --      2.1714                 2.9831                 3.2389
 Frc consts  --      0.2257                 0.3657                 0.4402
 IR Inten    --      0.7982                 0.6548                 0.2993
 RamAct Fr= 1--      0.9909                 1.4013                 6.9972
  Dep-P Fr= 1--      0.4769                 0.4672                 0.3672
  Dep-U Fr= 1--      0.6458                 0.6368                 0.5371
 Alpha2 Fr= 1--      0.0054                 0.0080                 0.0581
 Beta2  Fr= 1--      0.1067                 0.1487                 0.6264
 AlphaG Fr= 1--     -0.0174                -0.0059                -0.0398
 Gamma2 Fr= 1--     -0.2316                -0.6843                 0.6565
 Delta2 Fr= 1--      0.0324                -0.2749                 0.4948
 Raman1 Fr= 1--       3.963                  5.605                 27.989
 ROA1   Fr= 1--     -21.194                -74.487                 78.860
 CID1   Fr= 1--      -5.347                -13.289                  2.818
 Raman2 Fr= 1--       1.280                  1.785                  7.517
 ROA2   Fr= 1--      -5.817                -14.224                 11.798
 CID2   Fr= 1--      -4.545                 -7.969                  1.569
 Raman3 Fr= 1--       2.560                  3.570                 15.033
 ROA3   Fr= 1--     -21.194                -74.487                 78.860
 CID3   Fr= 1--      -8.280                -20.867                  5.246
 RC180  Fr= 1--       0.292                  0.274                  0.074
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.04   0.02  -0.07    -0.15  -0.04  -0.05     0.04   0.04   0.01
     2   6    -0.06   0.05  -0.06    -0.06   0.04   0.01     0.10   0.02   0.05
     3   6     0.01  -0.06   0.04    -0.08  -0.04  -0.11    -0.12   0.14  -0.11
     4   6     0.02  -0.06  -0.03    -0.01   0.03   0.01    -0.14   0.16   0.02
     5   6     0.04   0.01  -0.02    -0.04  -0.02  -0.07    -0.11  -0.08  -0.07
     6   6    -0.02  -0.06  -0.03     0.14   0.04   0.08    -0.03  -0.11  -0.01
     7   6    -0.07  -0.05   0.03     0.03   0.05  -0.04     0.12  -0.10   0.04
     8   6     0.18   0.10   0.09     0.07   0.02  -0.05     0.13  -0.06  -0.00
     9   1     0.03   0.17  -0.10    -0.14  -0.10  -0.07    -0.07  -0.25   0.04
    10   1    -0.10   0.03  -0.29     0.03   0.04   0.09    -0.01   0.03  -0.02
    11   1     0.06   0.24  -0.02    -0.11  -0.03  -0.01     0.14   0.06   0.06
    12   1     0.05  -0.09  -0.09    -0.09   0.15   0.17    -0.14   0.27   0.02
    13   1    -0.02  -0.03  -0.07     0.18  -0.02  -0.01    -0.12   0.08   0.16
    14   1     0.05   0.10  -0.14    -0.18  -0.02  -0.03    -0.02  -0.10  -0.06
    15   6    -0.02   0.00   0.00    -0.09  -0.09   0.10     0.02   0.01   0.05
    16   6    -0.07  -0.03   0.06     0.21   0.03   0.08    -0.06  -0.04  -0.03
    17   1    -0.11  -0.10  -0.00    -0.04  -0.02  -0.10     0.12  -0.09  -0.02
    18   1     0.37   0.23  -0.14     0.12   0.16  -0.11     0.18   0.26  -0.07
    19   1     0.32   0.14   0.40     0.17  -0.06   0.05     0.33  -0.24   0.14
    20   1    -0.03   0.06   0.00    -0.16  -0.27   0.35     0.01   0.17   0.01
    21   1    -0.01  -0.00   0.10    -0.24  -0.06  -0.07     0.11  -0.01   0.25
    22   1    -0.03   0.07  -0.04    -0.22  -0.09  -0.03     0.00   0.09  -0.01
    23   1    -0.12   0.01   0.09     0.24   0.02   0.07     0.01   0.01  -0.03
    24   1     0.02   0.01   0.14     0.18   0.01   0.05    -0.08  -0.04  -0.05
    25   1    -0.14  -0.02   0.07     0.25   0.03   0.08    -0.10  -0.03  -0.09
    26   1    -0.12  -0.03  -0.17    -0.14  -0.03  -0.03     0.21   0.09   0.18
                     13                     14                     15
                      A                      A                      A
 Frequencies --    534.0723               616.0103               649.6223
 Red. masses --      2.3221                 3.4550                 2.7700
 Frc consts  --      0.3902                 0.7725                 0.6887
 IR Inten    --      3.2799                 2.6774                 0.7256
 RamAct Fr= 1--      1.5495                 1.6769                24.0455
  Dep-P Fr= 1--      0.4133                 0.7102                 0.0075
  Dep-U Fr= 1--      0.5849                 0.8306                 0.0149
 Alpha2 Fr= 1--      0.0109                 0.0012                 0.5250
 Beta2  Fr= 1--      0.1510                 0.2321                 0.0598
 AlphaG Fr= 1--     -0.0338                -0.0144                 0.2655
 Gamma2 Fr= 1--      0.7627                -1.5605                -0.4454
 Delta2 Fr= 1--      0.4631                -0.7640                -0.1943
 Raman1 Fr= 1--       6.198                  6.708                 96.182
 ROA1   Fr= 1--      88.042               -174.256                -48.979
 CID1   Fr= 1--      14.205                -25.978                 -0.509
 Raman2 Fr= 1--       1.812                  2.786                  0.718
 ROA2   Fr= 1--      14.601                -31.340                 -9.136
 CID2   Fr= 1--       8.056                -11.251                -12.731
 Raman3 Fr= 1--       3.625                  5.571                  1.435
 ROA3   Fr= 1--      88.042               -174.256                -48.979
 CID3   Fr= 1--      24.288                -31.278                -34.128
 RC180  Fr= 1--       0.170                  0.661                 -0.970
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.07  -0.01   0.03     0.06  -0.06   0.02    -0.05   0.03   0.03
     2   6     0.06   0.10   0.07     0.05  -0.15  -0.13     0.01   0.14   0.09
     3   6    -0.12  -0.05   0.16    -0.10   0.02   0.21     0.08  -0.03  -0.09
     4   6    -0.02   0.03  -0.03    -0.04   0.11  -0.01     0.06  -0.08  -0.01
     5   6     0.01  -0.04  -0.07     0.01   0.13  -0.02     0.04   0.02  -0.11
     6   6     0.07  -0.06  -0.09    -0.02  -0.06   0.05    -0.06  -0.03   0.06
     7   6     0.10  -0.03   0.06    -0.01  -0.04  -0.12     0.08   0.09  -0.03
     8   6    -0.04  -0.03   0.00    -0.01   0.11  -0.13     0.02  -0.01  -0.04
     9   1     0.22   0.18  -0.16     0.17   0.13  -0.02     0.09   0.08  -0.07
    10   1     0.08   0.07  -0.10     0.05  -0.13   0.00     0.09   0.12   0.08
    11   1     0.07   0.26   0.10    -0.04  -0.25  -0.16    -0.07   0.15   0.08
    12   1    -0.06  -0.01   0.04    -0.09   0.08   0.08    -0.11  -0.25   0.33
    13   1     0.11   0.15  -0.32     0.11   0.25  -0.33     0.17   0.01  -0.25
    14   1     0.10  -0.03  -0.11     0.16   0.13  -0.05     0.03   0.06  -0.18
    15   6    -0.01   0.04  -0.08     0.03  -0.08   0.17     0.02  -0.08   0.17
    16   6     0.04  -0.00   0.01    -0.02   0.00  -0.01    -0.16  -0.04  -0.06
    17   1     0.04  -0.10   0.07     0.07   0.03   0.02     0.08   0.13  -0.20
    18   1    -0.21  -0.06   0.21     0.07   0.06  -0.22    -0.10  -0.01   0.10
    19   1    -0.16  -0.02  -0.21    -0.00   0.19  -0.00    -0.05  -0.04  -0.22
    20   1    -0.06   0.09   0.00     0.03  -0.07   0.19     0.05  -0.03   0.08
    21   1    -0.04   0.03   0.07     0.04  -0.08   0.20     0.06  -0.09   0.20
    22   1    -0.08   0.17  -0.22     0.03  -0.07   0.17     0.07  -0.10   0.24
    23   1    -0.07  -0.03   0.02     0.12   0.09  -0.01    -0.05  -0.01  -0.07
    24   1     0.12   0.01   0.09    -0.05   0.04  -0.07    -0.24  -0.06  -0.14
    25   1     0.02  -0.00   0.05    -0.12   0.02  -0.10    -0.16  -0.04  -0.12
    26   1    -0.32  -0.15  -0.28    -0.04  -0.23  -0.20    -0.17   0.06  -0.05
                     16                     17                     18
                      A                      A                      A
 Frequencies --    734.4905               777.6637               799.5220
 Red. masses --      1.4072                 2.2336                 1.5741
 Frc consts  --      0.4473                 0.7959                 0.5928
 IR Inten    --      0.4474                 2.1128                 0.3752
 RamAct Fr= 1--      4.0792                 5.8827                 1.5926
  Dep-P Fr= 1--      0.2639                 0.1085                 0.7174
  Dep-U Fr= 1--      0.4176                 0.1958                 0.8354
 Alpha2 Fr= 1--      0.0465                 0.1009                 0.0009
 Beta2  Fr= 1--      0.2839                 0.1920                 0.2217
 AlphaG Fr= 1--     -0.4171                 0.4692                -0.0513
 Gamma2 Fr= 1--     -0.4476                 0.7647                -0.0454
 Delta2 Fr= 1--      0.5147                 0.7761                 1.5247
 Raman1 Fr= 1--      16.317                 23.531                  6.370
 ROA1   Fr= 1--     -26.498                 98.245                 44.435
 CID1   Fr= 1--      -1.624                  4.175                  6.975
 Raman2 Fr= 1--       3.407                  2.304                  2.661
 ROA2   Fr= 1--     -14.859                 12.144                -13.287
 CID2   Fr= 1--      -4.362                  5.272                 -4.993
 Raman3 Fr= 1--       6.813                  4.607                  5.322
 ROA3   Fr= 1--     -26.498                 98.245                 44.435
 CID3   Fr= 1--      -3.889                 21.325                  8.349
 RC180  Fr= 1--      -0.165                 -0.608                  0.671
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01  -0.03  -0.01    -0.13  -0.11  -0.06     0.01   0.02  -0.08
     2   6     0.00  -0.06  -0.02    -0.01  -0.06  -0.03     0.03   0.07  -0.05
     3   6     0.03   0.06  -0.05    -0.02   0.06  -0.03    -0.04  -0.03   0.03
     4   6    -0.02   0.04   0.00    -0.06   0.08  -0.00    -0.01  -0.00   0.00
     5   6     0.03   0.01   0.02     0.16   0.07   0.02     0.02  -0.02   0.02
     6   6    -0.03   0.06   0.03    -0.00   0.01   0.00     0.03  -0.07  -0.03
     7   6    -0.03  -0.04   0.03     0.03   0.05  -0.00    -0.05   0.10  -0.02
     8   6     0.02  -0.07   0.04     0.09  -0.06   0.11    -0.01  -0.03   0.11
     9   1     0.08  -0.00  -0.07    -0.13  -0.17  -0.07    -0.28  -0.11   0.13
    10   1    -0.01  -0.08  -0.15     0.14  -0.11  -0.15     0.03   0.15   0.45
    11   1     0.06   0.07   0.00     0.03   0.08  -0.01     0.07  -0.42  -0.09
    12   1    -0.31  -0.22   0.56     0.04   0.18  -0.22    -0.10  -0.04   0.16
    13   1     0.18   0.25  -0.49    -0.24  -0.01   0.27     0.15   0.11  -0.27
    14   1     0.02  -0.04   0.09     0.25   0.17  -0.13     0.03   0.02  -0.04
    15   6    -0.02   0.04  -0.04     0.00  -0.01   0.03     0.01  -0.01  -0.02
    16   6     0.01   0.01   0.01    -0.03  -0.00  -0.02    -0.00  -0.02  -0.01
    17   1     0.01   0.01   0.03     0.08   0.13  -0.14    -0.09   0.06  -0.09
    18   1     0.08  -0.06  -0.03    -0.07  -0.43   0.32     0.04  -0.11   0.05
    19   1     0.06  -0.08   0.11    -0.18   0.08  -0.21    -0.02  -0.01   0.11
    20   1     0.01  -0.02  -0.10     0.01  -0.02   0.02    -0.02   0.05   0.03
    21   1    -0.00   0.04  -0.17     0.01  -0.01   0.01     0.01  -0.02   0.13
    22   1     0.03  -0.06   0.05     0.02  -0.03   0.05    -0.03   0.10  -0.11
    23   1    -0.00  -0.02  -0.00    -0.08  -0.00  -0.00    -0.03   0.04   0.02
    24   1    -0.03  -0.03  -0.00     0.01   0.02   0.01     0.10   0.07   0.05
    25   1     0.09   0.00   0.03    -0.07  -0.00   0.00    -0.15  -0.00  -0.02
    26   1    -0.07  -0.01  -0.05    -0.13  -0.06  -0.02     0.35  -0.13   0.08
                     19                     20                     21
                      A                      A                      A
 Frequencies --    833.8524               864.3223               892.7482
 Red. masses --      2.2210                 2.3719                 2.1851
 Frc consts  --      0.9099                 1.0440                 1.0261
 IR Inten    --      0.3716                 5.0505                 0.7622
 RamAct Fr= 1--      2.8497                12.1806                 3.4770
  Dep-P Fr= 1--      0.3787                 0.5038                 0.3088
  Dep-U Fr= 1--      0.5493                 0.6701                 0.4719
 Alpha2 Fr= 1--      0.0227                 0.0591                 0.0347
 Beta2  Fr= 1--      0.2609                 1.3603                 0.2735
 AlphaG Fr= 1--     -0.0083                -0.3876                 0.0117
 Gamma2 Fr= 1--     -0.3399                -3.3983                 1.6907
 Delta2 Fr= 1--     -0.2027                -1.2352                 0.4395
 Raman1 Fr= 1--      11.399                 48.722                 13.908
 ROA1   Fr= 1--     -39.119               -365.766                176.371
 CID1   Fr= 1--      -3.432                 -7.507                 12.681
 Raman2 Fr= 1--       3.131                 16.323                  3.282
 ROA2   Fr= 1--      -6.536                -71.678                 37.061
 CID2   Fr= 1--      -2.088                 -4.391                 11.293
 Raman3 Fr= 1--       6.262                 32.647                  6.564
 ROA3   Fr= 1--     -39.119               -365.766                176.371
 CID3   Fr= 1--      -6.247                -11.204                 26.871
 RC180  Fr= 1--       0.099                  0.340                 -0.056
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.04   0.11  -0.01    -0.11  -0.01   0.02     0.15  -0.00   0.09
     2   6    -0.04  -0.06  -0.11    -0.00  -0.07  -0.07    -0.05  -0.02  -0.01
     3   6    -0.02  -0.03   0.06     0.08   0.05  -0.03    -0.02  -0.01  -0.02
     4   6     0.01  -0.03   0.01     0.04   0.02  -0.01    -0.01   0.00  -0.04
     5   6    -0.00  -0.06  -0.10    -0.08  -0.05   0.16    -0.06   0.02  -0.05
     6   6    -0.04   0.07   0.04     0.06  -0.08  -0.04    -0.05  -0.06   0.00
     7   6     0.16  -0.10  -0.00     0.13   0.06  -0.06    -0.01   0.04  -0.13
     8   6     0.01   0.03   0.11    -0.03   0.12   0.04    -0.02  -0.05   0.17
     9   1    -0.29   0.13   0.18    -0.05   0.11  -0.01     0.38   0.14  -0.07
    10   1    -0.27   0.01   0.03     0.12  -0.10  -0.11    -0.02  -0.04  -0.11
    11   1    -0.06  -0.23  -0.13    -0.14   0.02  -0.09    -0.25   0.13  -0.04
    12   1     0.07  -0.08  -0.09    -0.08  -0.28   0.24    -0.11   0.15   0.14
    13   1     0.01   0.05  -0.12    -0.17   0.06   0.03     0.09  -0.14   0.17
    14   1    -0.01   0.00  -0.20    -0.14  -0.18   0.33    -0.04   0.17  -0.26
    15   6    -0.01   0.03   0.01     0.02  -0.03  -0.02    -0.02  -0.01  -0.02
    16   6    -0.00   0.04   0.02    -0.02  -0.04  -0.03     0.09   0.00   0.04
    17   1     0.22  -0.02  -0.05     0.21   0.15  -0.05     0.08   0.20  -0.43
    18   1    -0.20   0.17   0.36    -0.15   0.35   0.17    -0.04   0.03   0.20
    19   1    -0.11   0.10  -0.04     0.01   0.02  -0.00    -0.04  -0.04   0.15
    20   1     0.02  -0.05  -0.04    -0.02   0.06   0.03    -0.01   0.06  -0.09
    21   1     0.01   0.04  -0.17    -0.00  -0.04   0.19     0.01  -0.02   0.06
    22   1     0.03  -0.12   0.14    -0.03   0.13  -0.16     0.01   0.03  -0.03
    23   1     0.04  -0.09  -0.04    -0.10   0.03   0.01     0.19   0.09   0.05
    24   1    -0.19  -0.14  -0.09     0.14   0.07   0.08     0.09   0.07   0.00
    25   1     0.27   0.01   0.03    -0.20  -0.02  -0.02    -0.03   0.02  -0.04
    26   1     0.17   0.04   0.10    -0.20   0.07   0.01    -0.14   0.07  -0.10
                     22                     23                     24
                      A                      A                      A
 Frequencies --    909.6935               919.4357               941.1284
 Red. masses --      1.4301                 1.8501                 2.0311
 Frc consts  --      0.6973                 0.9215                 1.0599
 IR Inten    --     35.2518                 5.6351                 1.6390
 RamAct Fr= 1--      9.8115                 1.6823                 5.8144
  Dep-P Fr= 1--      0.7049                 0.5071                 0.5129
  Dep-U Fr= 1--      0.8269                 0.6729                 0.6780
 Alpha2 Fr= 1--      0.0077                 0.0080                 0.0270
 Beta2  Fr= 1--      1.3522                 0.1887                 0.6571
 AlphaG Fr= 1--     -0.0578                -0.0972                 0.0659
 Gamma2 Fr= 1--     -0.1300                 0.3865                 4.3798
 Delta2 Fr= 1--      0.3953                -0.4559                 2.0383
 Raman1 Fr= 1--      39.246                  6.729                 23.258
 ROA1   Fr= 1--       0.172                 22.512                485.686
 CID1   Fr= 1--       0.004                  3.345                 20.883
 Raman2 Fr= 1--      16.226                  2.264                  7.885
 ROA2   Fr= 1--      -6.282                 12.923                 88.809
 CID2   Fr= 1--      -0.387                  5.708                 11.264
 Raman3 Fr= 1--      32.453                  4.528                 15.769
 ROA3   Fr= 1--       0.172                 22.512                485.686
 CID3   Fr= 1--       0.005                  4.971                 30.800
 RC180  Fr= 1--       0.654                  0.346                  0.356
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.03  -0.01   0.00     0.04   0.06  -0.02    -0.08   0.05   0.01
     2   6     0.03   0.02  -0.01    -0.06  -0.00  -0.00     0.03  -0.08  -0.05
     3   6    -0.02  -0.01   0.06    -0.06  -0.06  -0.01     0.04   0.01   0.03
     4   6     0.08   0.07  -0.12    -0.01  -0.04  -0.09     0.05  -0.02   0.03
     5   6     0.02  -0.03  -0.05    -0.03   0.13   0.11    -0.09   0.13  -0.06
     6   6    -0.01   0.02   0.01     0.02  -0.01  -0.01    -0.05  -0.05   0.01
     7   6    -0.02   0.00   0.02     0.05  -0.06   0.04    -0.01   0.08   0.09
     8   6    -0.02  -0.02  -0.01     0.10   0.02  -0.05     0.02  -0.10  -0.03
     9   1    -0.04   0.04   0.03    -0.08   0.02   0.07    -0.17   0.20   0.11
    10   1     0.06   0.03   0.11    -0.28   0.03  -0.06     0.07  -0.09  -0.07
    11   1     0.05  -0.10  -0.02    -0.00   0.00   0.01     0.13  -0.03  -0.03
    12   1    -0.23  -0.28   0.47    -0.26   0.19   0.39     0.12  -0.18  -0.10
    13   1    -0.38  -0.19   0.57     0.27  -0.26   0.17    -0.09   0.05  -0.03
    14   1     0.09  -0.02  -0.09    -0.16   0.15   0.12    -0.11   0.28  -0.26
    15   6    -0.00   0.01   0.00     0.01  -0.01  -0.01    -0.01  -0.04  -0.04
    16   6    -0.01   0.01   0.01    -0.00  -0.01  -0.02     0.05   0.01   0.04
    17   1    -0.04  -0.03   0.07     0.03  -0.09   0.07     0.11   0.20   0.20
    18   1     0.05   0.03  -0.10    -0.09  -0.27   0.19     0.07  -0.07  -0.09
    19   1     0.02   0.01   0.10    -0.06  -0.02  -0.38     0.19  -0.43  -0.14
    20   1     0.00  -0.01  -0.00    -0.01   0.03   0.01    -0.03   0.17  -0.10
    21   1     0.00   0.01  -0.04    -0.00  -0.02   0.08     0.04  -0.06   0.27
    22   1     0.01  -0.03   0.04    -0.01   0.05  -0.06     0.01   0.16  -0.13
    23   1     0.02  -0.02  -0.01    -0.09  -0.01  -0.00     0.18   0.04   0.03
    24   1    -0.07  -0.04  -0.03     0.07   0.03   0.04    -0.02   0.01  -0.04
    25   1     0.07   0.00   0.00    -0.05  -0.00   0.02     0.05   0.01  -0.02
    26   1     0.01  -0.09  -0.03     0.14   0.04   0.05    -0.05   0.08   0.06
                     25                     26                     27
                      A                      A                      A
 Frequencies --    956.9516               970.4257               992.5283
 Red. masses --      1.5056                 1.9395                 1.6957
 Frc consts  --      0.8124                 1.0761                 0.9842
 IR Inten    --      0.9269                 1.0595                 0.3031
 RamAct Fr= 1--      3.5719                 3.3004                 0.9754
  Dep-P Fr= 1--      0.6172                 0.7295                 0.5326
  Dep-U Fr= 1--      0.7633                 0.8436                 0.6951
 Alpha2 Fr= 1--      0.0087                 0.0012                 0.0041
 Beta2  Fr= 1--      0.4544                 0.4640                 0.1130
 AlphaG Fr= 1--      0.0296                 0.0078                 0.0337
 Gamma2 Fr= 1--      0.3933                -2.4493                -0.0117
 Delta2 Fr= 1--     -0.1455                -1.9523                -0.1149
 Raman1 Fr= 1--      14.288                 13.202                  3.902
 ROA1   Fr= 1--      33.103               -297.603                 -4.797
 CID1   Fr= 1--       2.317                -22.543                 -1.230
 Raman2 Fr= 1--       5.453                  5.568                  1.356
 ROA2   Fr= 1--      10.605                -43.164                  0.640
 CID2   Fr= 1--       1.945                 -7.752                  0.472
 Raman3 Fr= 1--      10.906                 11.137                  2.712
 ROA3   Fr= 1--      33.103               -297.603                 -4.797
 CID3   Fr= 1--       3.035                -26.723                 -1.769
 RC180  Fr= 1--       0.527                  0.687                  0.390
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00   0.00   0.03    -0.04  -0.03  -0.05    -0.08   0.03   0.10
     2   6    -0.00  -0.01  -0.03     0.02   0.06   0.04     0.08   0.04  -0.07
     3   6     0.00  -0.00  -0.01     0.01   0.00  -0.00    -0.00  -0.00  -0.07
     4   6    -0.01  -0.01  -0.00     0.02   0.00   0.01    -0.06  -0.05  -0.03
     5   6    -0.01   0.03  -0.01     0.03   0.02   0.05     0.06   0.03   0.04
     6   6     0.09   0.02   0.05    -0.08  -0.09   0.10    -0.00  -0.02   0.04
     7   6     0.01   0.00   0.01     0.03  -0.06  -0.04     0.07  -0.03  -0.01
     8   6    -0.01  -0.04   0.03     0.01   0.06  -0.06    -0.05  -0.02   0.00
     9   1     0.05   0.09   0.01    -0.09  -0.16  -0.04     0.06   0.26   0.03
    10   1     0.01  -0.01   0.00     0.01   0.06   0.08     0.14   0.07   0.23
    11   1    -0.06  -0.03  -0.04     0.05  -0.01   0.04    -0.17  -0.20  -0.14
    12   1     0.00   0.06  -0.03     0.01  -0.08   0.01    -0.06   0.35  -0.03
    13   1     0.03  -0.04   0.03    -0.05   0.04  -0.03     0.26  -0.20   0.09
    14   1    -0.05   0.06  -0.04     0.10   0.01   0.04     0.12   0.04   0.01
    15   6     0.10   0.05  -0.04    -0.05   0.04  -0.10    -0.04   0.00  -0.03
    16   6    -0.11  -0.05   0.02     0.04  -0.05   0.12    -0.01   0.01  -0.00
    17   1    -0.00  -0.02   0.07     0.02  -0.04  -0.16     0.09  -0.06   0.27
    18   1     0.04  -0.03  -0.02    -0.05  -0.01   0.02     0.17  -0.11  -0.26
    19   1     0.03  -0.08   0.05    -0.10   0.18  -0.12     0.03   0.08   0.29
    20   1    -0.06  -0.25   0.48    -0.00   0.11  -0.27     0.01   0.11  -0.21
    21   1    -0.25   0.11  -0.28     0.03   0.03  -0.09     0.08  -0.02   0.05
    22   1    -0.22   0.07  -0.37     0.02   0.01  -0.00     0.06   0.00   0.07
    23   1     0.23   0.08  -0.01     0.63   0.23   0.10    -0.05  -0.04  -0.01
    24   1    -0.29  -0.01  -0.20    -0.20   0.08  -0.21    -0.03  -0.04   0.01
    25   1    -0.20  -0.03  -0.20    -0.20  -0.00  -0.25     0.06  -0.00   0.04
    26   1    -0.07   0.01  -0.02     0.07  -0.06   0.01    -0.24  -0.00  -0.06
                     28                     29                     30
                      A                      A                      A
 Frequencies --   1012.3060              1032.9575              1066.5896
 Red. masses --      1.4767                 1.8057                 1.7341
 Frc consts  --      0.8916                 1.1352                 1.1623
 IR Inten    --      0.1185                 0.1835                 0.4068
 RamAct Fr= 1--      1.4898                 5.3171                 5.7488
  Dep-P Fr= 1--      0.1574                 0.1000                 0.4634
  Dep-U Fr= 1--      0.2719                 0.1818                 0.6333
 Alpha2 Fr= 1--      0.0226                 0.0931                 0.0334
 Beta2  Fr= 1--      0.0675                 0.1611                 0.6068
 AlphaG Fr= 1--      0.0061                 0.0693                -0.0931
 Gamma2 Fr= 1--      0.8237                -0.3782                -0.4389
 Delta2 Fr= 1--      0.5268                -0.4592                -0.8838
 Raman1 Fr= 1--       5.959                 21.268                 22.995
 ROA1   Fr= 1--      95.936                -51.004                -70.422
 CID1   Fr= 1--      16.099                 -2.398                 -3.062
 Raman2 Fr= 1--       0.810                  1.933                  7.282
 ROA2   Fr= 1--      15.556                 -5.403                 -3.464
 CID2   Fr= 1--      19.199                 -2.795                 -0.476
 Raman3 Fr= 1--       1.620                  3.866                 14.563
 ROA3   Fr= 1--      95.936                -51.004                -70.422
 CID3   Fr= 1--      59.203                -13.192                 -4.836
 RC180  Fr= 1--      -0.456                 -0.636                  0.267
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03  -0.09  -0.02    -0.01  -0.08   0.00     0.07  -0.09  -0.02
     2   6    -0.05   0.06  -0.01    -0.01   0.09  -0.02    -0.13   0.02  -0.06
     3   6     0.03   0.02  -0.01     0.03   0.01  -0.01     0.02   0.02   0.02
     4   6     0.02   0.02   0.02     0.05   0.03   0.04    -0.04  -0.00  -0.02
     5   6    -0.02   0.04   0.03    -0.08   0.13   0.02     0.07  -0.01  -0.03
     6   6     0.01   0.00   0.01     0.03  -0.01   0.02     0.01  -0.01   0.02
     7   6     0.03  -0.04  -0.02     0.06  -0.10  -0.02     0.03   0.09   0.11
     8   6     0.01  -0.00   0.01    -0.02  -0.04   0.03    -0.01  -0.01  -0.03
     9   1     0.11  -0.12  -0.09     0.09  -0.08  -0.08     0.07   0.03  -0.00
    10   1    -0.03   0.07   0.12    -0.06   0.13   0.19    -0.15   0.04   0.05
    11   1    -0.17  -0.07  -0.05    -0.14  -0.16  -0.07    -0.16  -0.08  -0.07
    12   1     0.04  -0.10  -0.02     0.13  -0.22  -0.09    -0.05   0.19  -0.01
    13   1    -0.10   0.09  -0.03    -0.21   0.13  -0.01     0.10  -0.08   0.05
    14   1     0.00   0.04   0.02    -0.19   0.26  -0.13     0.38  -0.17   0.11
    15   6     0.02  -0.07  -0.04    -0.03   0.07   0.02    -0.03   0.01  -0.01
    16   6    -0.04   0.09   0.03     0.01  -0.04  -0.06    -0.01  -0.02   0.01
    17   1    -0.10  -0.18  -0.05    -0.07  -0.26  -0.02    -0.00   0.04   0.20
    18   1    -0.01  -0.03   0.03    -0.02   0.06   0.04    -0.14   0.47   0.12
    19   1    -0.02   0.04   0.02     0.10  -0.23   0.02     0.21  -0.42  -0.16
    20   1    -0.05   0.17   0.03     0.04  -0.10  -0.09     0.01   0.03  -0.12
    21   1     0.00  -0.08   0.36     0.03   0.07  -0.29     0.05   0.00  -0.02
    22   1    -0.03   0.24  -0.26     0.04  -0.18   0.22     0.04  -0.03   0.09
    23   1    -0.01  -0.20  -0.10    -0.20   0.03   0.02     0.07   0.04   0.02
    24   1    -0.34  -0.24  -0.12     0.25   0.10   0.13    -0.03   0.01  -0.02
    25   1     0.48   0.03   0.08    -0.20  -0.02   0.04    -0.09  -0.01  -0.05
    26   1    -0.01  -0.11  -0.07    -0.04  -0.18  -0.10     0.02  -0.13  -0.09
                     31                     32                     33
                      A                      A                      A
 Frequencies --   1080.4611              1103.0372              1132.2573
 Red. masses --      1.8455                 1.3001                 1.4716
 Frc consts  --      1.2693                 0.9320                 1.1115
 IR Inten    --      1.1460                 0.1015                 5.1091
 RamAct Fr= 1--      2.6988                 2.9291                 3.6537
  Dep-P Fr= 1--      0.6965                 0.3486                 0.6029
  Dep-U Fr= 1--      0.8211                 0.5170                 0.7523
 Alpha2 Fr= 1--      0.0025                 0.0258                 0.0099
 Beta2  Fr= 1--      0.3693                 0.2524                 0.4581
 AlphaG Fr= 1--      0.0266                 0.0299                -0.1703
 Gamma2 Fr= 1--     -2.3070                 0.6707                -3.2458
 Delta2 Fr= 1--     -0.9438                 0.4211                -0.9174
 Raman1 Fr= 1--      10.795                 11.717                 14.615
 ROA1   Fr= 1--    -251.673                 77.861               -340.951
 CID1   Fr= 1--     -23.313                  6.645                -23.329
 Raman2 Fr= 1--       4.432                  3.029                  5.497
 ROA2   Fr= 1--     -47.818                 12.727                -70.559
 CID2   Fr= 1--     -10.789                  4.202                -12.836
 Raman3 Fr= 1--       8.864                  6.057                 10.994
 ROA3   Fr= 1--    -251.673                 77.861               -340.951
 CID3   Fr= 1--     -28.392                 12.854                -31.012
 RC180  Fr= 1--       0.642                  0.034                  0.505
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.05   0.02  -0.09    -0.03  -0.01   0.05    -0.00  -0.02   0.05
     2   6     0.00  -0.02   0.09     0.06  -0.00  -0.02    -0.00   0.02  -0.03
     3   6     0.00  -0.01   0.07     0.04   0.03  -0.02    -0.01  -0.01  -0.02
     4   6     0.00  -0.05  -0.03    -0.02  -0.02  -0.01     0.01   0.01   0.01
     5   6     0.05   0.13   0.02    -0.03   0.02   0.00     0.04   0.04  -0.08
     6   6     0.00   0.01   0.01    -0.00  -0.01  -0.02    -0.02   0.08   0.06
     7   6     0.05  -0.05  -0.05    -0.09  -0.04  -0.01    -0.02  -0.04   0.06
     8   6    -0.13  -0.07   0.00     0.05   0.01   0.00     0.02  -0.06  -0.03
     9   1    -0.21  -0.16  -0.00    -0.04   0.31   0.12     0.06   0.10   0.02
    10   1     0.01  -0.06  -0.14     0.25  -0.02   0.10    -0.24   0.09   0.07
    11   1     0.12   0.16   0.13     0.38  -0.14   0.02     0.13  -0.13  -0.02
    12   1    -0.03   0.11   0.03    -0.03   0.13  -0.01     0.05  -0.02  -0.07
    13   1     0.16  -0.13   0.04     0.10  -0.08   0.04    -0.09   0.02   0.05
    14   1     0.27   0.03   0.10     0.07  -0.06   0.08    -0.30  -0.23   0.37
    15   6     0.02  -0.01  -0.01     0.00   0.01   0.01     0.01  -0.05  -0.03
    16   6    -0.01   0.02  -0.02    -0.00   0.03   0.01     0.01  -0.05  -0.03
    17   1     0.11   0.08  -0.40    -0.31  -0.23  -0.38     0.19   0.26  -0.26
    18   1    -0.02   0.42  -0.14    -0.19   0.27   0.28    -0.04   0.11   0.04
    19   1     0.14  -0.18   0.36     0.02  -0.12  -0.21    -0.11   0.25   0.13
    20   1    -0.01  -0.00   0.07     0.01  -0.04   0.02    -0.04   0.12   0.03
    21   1    -0.03  -0.00   0.03    -0.00   0.01  -0.05    -0.02  -0.05   0.21
    22   1    -0.02   0.05  -0.08    -0.01  -0.03   0.02    -0.00   0.15  -0.15
    23   1    -0.10  -0.05  -0.02     0.01  -0.04  -0.02    -0.06   0.09   0.05
    24   1     0.02  -0.03   0.04    -0.05  -0.05  -0.01     0.15   0.11   0.05
    25   1     0.06   0.00   0.05     0.11   0.01   0.01    -0.21  -0.02   0.00
    26   1     0.14   0.07   0.10    -0.07  -0.10  -0.06    -0.03  -0.19  -0.11
                     34                     35                     36
                      A                      A                      A
 Frequencies --   1171.5632              1214.7820              1225.6054
 Red. masses --      1.5883                 1.5442                 1.5578
 Frc consts  --      1.2844                 1.3426                 1.3787
 IR Inten    --      2.2865                 1.4122                 1.0076
 RamAct Fr= 1--      9.8502                11.6806                 2.9264
  Dep-P Fr= 1--      0.7413                 0.5517                 0.6843
  Dep-U Fr= 1--      0.8514                 0.7111                 0.8126
 Alpha2 Fr= 1--      0.0015                 0.0442                 0.0034
 Beta2  Fr= 1--      1.3978                 1.3844                 0.3963
 AlphaG Fr= 1--     -0.0078                -0.1026                -0.0139
 Gamma2 Fr= 1--      1.3658                -2.1737                -0.4351
 Delta2 Fr= 1--     -0.6077                 0.3836                 0.6783
 Raman1 Fr= 1--      39.401                 46.723                 11.705
 ROA1   Fr= 1--     111.667               -196.396                -20.067
 CID1   Fr= 1--       2.834                 -4.203                 -1.714
 Raman2 Fr= 1--      16.773                 16.613                  4.756
 ROA2   Fr= 1--      37.640                -55.237                -15.870
 CID2   Fr= 1--       2.244                 -3.325                 -3.337
 Raman3 Fr= 1--      33.546                 33.225                  9.511
 ROA3   Fr= 1--     111.667               -196.396                -20.067
 CID3   Fr= 1--       3.329                 -5.911                 -2.110
 RC180  Fr= 1--       0.703                  0.422                  0.625
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03   0.03  -0.03     0.00  -0.01   0.02    -0.03   0.02   0.01
     2   6    -0.01  -0.05   0.01    -0.03  -0.01   0.02     0.06   0.03  -0.05
     3   6    -0.02  -0.02   0.05     0.01  -0.00  -0.02    -0.02   0.00   0.03
     4   6    -0.00   0.01  -0.01    -0.01   0.01   0.00     0.02  -0.02  -0.01
     5   6     0.03   0.04  -0.07     0.01   0.03  -0.01     0.02   0.08  -0.05
     6   6     0.13   0.03   0.06     0.12  -0.11  -0.07    -0.06  -0.06  -0.11
     7   6     0.01   0.03  -0.03     0.01   0.03   0.02    -0.05  -0.04   0.02
     8   6     0.01  -0.03   0.03    -0.04   0.02   0.01     0.02  -0.01   0.04
     9   1    -0.06   0.01   0.04    -0.04   0.17   0.08     0.16  -0.42  -0.22
    10   1     0.40  -0.13  -0.04    -0.29   0.02  -0.09     0.06   0.05   0.10
    11   1    -0.17   0.12  -0.01     0.27  -0.01   0.08    -0.25  -0.06  -0.12
    12   1    -0.01   0.02  -0.01     0.00   0.03  -0.02     0.03  -0.05  -0.01
    13   1    -0.03   0.02   0.00    -0.05   0.02   0.02     0.06  -0.05   0.02
    14   1    -0.42  -0.11   0.23    -0.28  -0.06   0.17    -0.12  -0.28   0.46
    15   6    -0.08  -0.02  -0.03    -0.05   0.04   0.03     0.02   0.02   0.04
    16   6    -0.05  -0.03   0.00    -0.04   0.04   0.04     0.01   0.03   0.04
    17   1    -0.29  -0.33   0.04     0.18   0.27  -0.23     0.10   0.13   0.09
    18   1    -0.02   0.04   0.06     0.12  -0.22  -0.17    -0.03   0.01   0.10
    19   1    -0.01   0.01   0.03     0.03  -0.05   0.05     0.03  -0.12  -0.08
    20   1     0.00   0.15  -0.29     0.05  -0.09  -0.16     0.02  -0.12   0.08
    21   1     0.15  -0.05   0.10     0.12   0.02  -0.14    -0.03   0.03  -0.07
    22   1     0.12   0.03   0.14     0.04  -0.13   0.21    -0.03  -0.11   0.07
    23   1     0.00   0.01  -0.00     0.09  -0.12  -0.06     0.13  -0.03  -0.01
    24   1    -0.11  -0.01  -0.07    -0.23  -0.12  -0.09    -0.07  -0.02  -0.03
    25   1    -0.13  -0.02  -0.07     0.17   0.02  -0.06     0.13   0.02  -0.04
    26   1     0.01   0.23   0.11     0.07  -0.28  -0.14    -0.13   0.31   0.15
                     37                     38                     39
                      A                      A                      A
 Frequencies --   1231.6600              1244.9767              1264.6837
 Red. masses --      1.7511                 2.2311                 1.4647
 Frc consts  --      1.5651                 2.0375                 1.3802
 IR Inten    --      1.1306                 2.5855                 1.1033
 RamAct Fr= 1--      9.9577                 5.3914                 4.9427
  Dep-P Fr= 1--      0.6328                 0.1595                 0.5301
  Dep-U Fr= 1--      0.7751                 0.2751                 0.6929
 Alpha2 Fr= 1--      0.0212                 0.0814                 0.0210
 Beta2  Fr= 1--      1.2865                 0.2472                 0.5708
 AlphaG Fr= 1--     -0.0563                -0.0426                -0.0712
 Gamma2 Fr= 1--     -1.4677                -1.9345                 1.2069
 Delta2 Fr= 1--     -0.6149                -0.8070                 0.7126
 Raman1 Fr= 1--      39.831                 21.566                 19.771
 ROA1   Fr= 1--    -160.577               -211.536                138.664
 CID1   Fr= 1--      -4.031                 -9.809                  7.014
 Raman2 Fr= 1--      15.437                  2.966                  6.850
 ROA2   Fr= 1--     -30.305                -39.972                 23.264
 CID2   Fr= 1--      -1.963                -13.477                  3.396
 Raman3 Fr= 1--      30.875                  5.932                 13.700
 ROA3   Fr= 1--    -160.577               -211.536                138.664
 CID3   Fr= 1--      -5.201                -35.662                 10.122
 RC180  Fr= 1--       0.550                 -0.450                  0.386
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03  -0.05  -0.05     0.02   0.02   0.01     0.03  -0.03  -0.04
     2   6    -0.07   0.01  -0.01    -0.00  -0.00  -0.05    -0.03   0.01   0.04
     3   6     0.05   0.03   0.03    -0.05  -0.04   0.00    -0.00  -0.01  -0.02
     4   6    -0.01  -0.01  -0.01     0.01   0.01   0.00    -0.00   0.02   0.01
     5   6    -0.09   0.03  -0.01     0.02  -0.03  -0.01     0.02   0.02  -0.06
     6   6    -0.03  -0.08  -0.04     0.04  -0.14   0.22    -0.11  -0.02   0.02
     7   6     0.05   0.04   0.08    -0.06  -0.01   0.08     0.04  -0.03   0.00
     8   6     0.06  -0.11  -0.07     0.01   0.06  -0.05    -0.03   0.08   0.05
     9   1    -0.12   0.21   0.12     0.09  -0.16  -0.07    -0.20   0.43   0.22
    10   1     0.39  -0.06   0.08     0.19  -0.02   0.09     0.31  -0.06   0.02
    11   1    -0.16   0.06  -0.01    -0.09  -0.02  -0.06    -0.22   0.11   0.01
    12   1    -0.03   0.05   0.03     0.02  -0.07  -0.01     0.00   0.01  -0.01
    13   1     0.07  -0.03  -0.01    -0.05   0.04  -0.02    -0.06   0.04  -0.00
    14   1     0.06  -0.03   0.04     0.04   0.04  -0.11    -0.04  -0.23   0.29
    15   6     0.01   0.04   0.02     0.01   0.05  -0.06     0.04   0.01  -0.00
    16   6     0.01   0.02   0.00    -0.01   0.06  -0.08     0.03   0.01  -0.01
    17   1     0.04   0.05  -0.02     0.14   0.32  -0.40    -0.00  -0.08  -0.02
    18   1    -0.03   0.07   0.04     0.01  -0.03  -0.05     0.15  -0.33  -0.15
    19   1    -0.28   0.64   0.28     0.04  -0.06  -0.17     0.12  -0.28  -0.13
    20   1     0.03  -0.12   0.03     0.02  -0.00  -0.09    -0.01  -0.04   0.13
    21   1    -0.03   0.05  -0.15    -0.05   0.07  -0.22    -0.11   0.03  -0.01
    22   1    -0.05  -0.11   0.05    -0.07   0.03  -0.13    -0.07  -0.02  -0.10
    23   1     0.01  -0.03  -0.02    -0.32  -0.14  -0.09    -0.04   0.02   0.01
    24   1     0.02  -0.02   0.03     0.08  -0.15   0.14     0.09   0.01   0.05
    25   1     0.08   0.01   0.02     0.12   0.02   0.22     0.02   0.00   0.07
    26   1     0.03   0.07   0.04    -0.11   0.30   0.13     0.12  -0.14  -0.07
                     40                     41                     42
                      A                      A                      A
 Frequencies --   1288.8859              1293.3832              1317.6069
 Red. masses --      1.6423                 1.7058                 1.8432
 Frc consts  --      1.6074                 1.6813                 1.8853
 IR Inten    --      2.7381                 0.8457                 0.5052
 RamAct Fr= 1--      5.2267                 3.2545                 5.0285
  Dep-P Fr= 1--      0.5490                 0.5573                 0.3352
  Dep-U Fr= 1--      0.7088                 0.7157                 0.5021
 Alpha2 Fr= 1--      0.0201                 0.0119                 0.0463
 Beta2  Fr= 1--      0.6175                 0.3882                 0.4208
 AlphaG Fr= 1--     -0.0225                 0.0378                -0.0455
 Gamma2 Fr= 1--      4.8289                 0.9101                -2.9251
 Delta2 Fr= 1--      3.7752                 0.3577                -1.1180
 Raman1 Fr= 1--      20.907                 13.018                 20.114
 ROA1   Fr= 1--     584.384                 98.815               -316.589
 CID1   Fr= 1--      27.952                  7.591                -15.740
 Raman2 Fr= 1--       7.410                  4.659                  5.050
 ROA2   Fr= 1--      85.692                 18.980                -61.260
 CID2   Fr= 1--      11.565                  4.074                -12.131
 Raman3 Fr= 1--      14.819                  9.317                 10.099
 ROA3   Fr= 1--     584.384                 98.815               -316.589
 CID3   Fr= 1--      39.435                 10.606                -31.347
 RC180  Fr= 1--       0.418                  0.431                  0.004
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.02   0.06   0.02     0.02   0.04   0.04    -0.03  -0.04   0.01
     2   6     0.02  -0.02   0.05     0.03  -0.04  -0.00    -0.04   0.00  -0.02
     3   6    -0.00  -0.01  -0.02    -0.14  -0.08  -0.11     0.08   0.09   0.08
     4   6     0.00   0.00   0.00     0.07   0.01   0.04    -0.02  -0.04  -0.03
     5   6     0.06   0.02  -0.01    -0.05   0.08  -0.00    -0.09   0.00  -0.10
     6   6    -0.04  -0.10   0.07     0.03  -0.01   0.01    -0.03  -0.04   0.09
     7   6    -0.04   0.04  -0.12     0.02   0.06  -0.01     0.07   0.07  -0.06
     8   6     0.04  -0.06  -0.00     0.02  -0.03   0.01     0.01   0.02   0.05
     9   1    -0.01  -0.04  -0.02     0.02   0.12   0.05     0.11  -0.23  -0.13
    10   1    -0.06  -0.02  -0.06    -0.21   0.00  -0.07    -0.27   0.04  -0.08
    11   1    -0.06   0.12   0.05     0.02   0.03   0.00     0.52  -0.12   0.07
    12   1     0.02   0.01  -0.03     0.13  -0.32  -0.07    -0.02   0.05  -0.01
    13   1    -0.04   0.00   0.02    -0.11   0.08  -0.02     0.21  -0.15   0.06
    14   1    -0.23   0.00   0.09     0.70  -0.25   0.27     0.07  -0.23   0.18
    15   6     0.02   0.03  -0.02    -0.01   0.01   0.00     0.01   0.01  -0.02
    16   6     0.01   0.05  -0.02    -0.00   0.00  -0.00     0.02   0.01  -0.03
    17   1     0.03   0.01   0.55    -0.18  -0.18  -0.01    -0.16  -0.24   0.15
    18   1    -0.14   0.33   0.21     0.00  -0.05   0.04     0.14  -0.30  -0.11
    19   1    -0.05   0.07  -0.00    -0.05   0.12   0.10    -0.05   0.07  -0.00
    20   1     0.01  -0.04   0.02     0.01  -0.00  -0.05     0.00  -0.01   0.00
    21   1    -0.07   0.04  -0.09     0.02   0.00  -0.03    -0.04   0.02  -0.04
    22   1    -0.07  -0.03  -0.08     0.00  -0.01   0.02    -0.04   0.00  -0.06
    23   1    -0.11  -0.09  -0.05    -0.01  -0.03  -0.01    -0.13  -0.01  -0.00
    24   1     0.01  -0.11   0.06    -0.02  -0.02  -0.00     0.05  -0.05   0.04
    25   1     0.08   0.02   0.10    -0.01   0.00  -0.01    -0.06   0.00   0.09
    26   1     0.20  -0.45  -0.21    -0.03   0.03  -0.00    -0.10   0.11   0.07
                     43                     44                     45
                      A                      A                      A
 Frequencies --   1327.0278              1349.9229              1373.8691
 Red. masses --      1.6437                 1.6964                 1.4409
 Frc consts  --      1.7054                 1.8214                 1.6024
 IR Inten    --      1.8627                 1.4534                 0.2508
 RamAct Fr= 1--      1.3458                 3.9086                 2.3883
  Dep-P Fr= 1--      0.5898                 0.5838                 0.7367
  Dep-U Fr= 1--      0.7420                 0.7372                 0.8484
 Alpha2 Fr= 1--      0.0040                 0.0122                 0.0005
 Beta2  Fr= 1--      0.1664                 0.4802                 0.3377
 AlphaG Fr= 1--     -0.0044                -0.0217                -0.0005
 Gamma2 Fr= 1--      1.7381                -0.8543                -0.1555
 Delta2 Fr= 1--      1.2281                -1.0841                -0.3654
 Raman1 Fr= 1--       5.383                 15.634                  9.553
 ROA1   Fr= 1--     206.158               -116.708                -26.619
 CID1   Fr= 1--      38.295                 -7.465                 -2.786
 Raman2 Fr= 1--       1.997                  5.763                  4.052
 ROA2   Fr= 1--      31.890                -11.831                 -0.809
 CID2   Fr= 1--      15.967                 -2.053                 -0.200
 Raman3 Fr= 1--       3.994                 11.526                  8.105
 ROA3   Fr= 1--     206.158               -116.708                -26.619
 CID3   Fr= 1--      51.612                -10.126                 -3.284
 RC180  Fr= 1--       0.484                  0.474                  0.697
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.04  -0.06   0.01    -0.01   0.13   0.07     0.03   0.02   0.03
     2   6    -0.02   0.02  -0.02    -0.07  -0.05  -0.05    -0.14   0.04  -0.02
     3   6    -0.05  -0.08  -0.03    -0.03   0.00  -0.03    -0.05  -0.02  -0.03
     4   6     0.00   0.04   0.01     0.01  -0.01   0.00     0.02   0.01   0.01
     5   6     0.12   0.00   0.04     0.05  -0.01   0.02    -0.00   0.02   0.01
     6   6    -0.09  -0.05  -0.03    -0.06  -0.01  -0.03     0.02   0.03  -0.01
     7   6     0.06   0.06  -0.01     0.09   0.05   0.09    -0.01  -0.07  -0.06
     8   6    -0.03  -0.03  -0.02    -0.03   0.00  -0.02    -0.00   0.01   0.01
     9   1    -0.00   0.18   0.09     0.17  -0.44  -0.19     0.08  -0.06  -0.03
    10   1    -0.17   0.05  -0.02     0.30  -0.12  -0.00     0.55  -0.07   0.12
    11   1     0.40  -0.10   0.04     0.07   0.00  -0.02     0.56  -0.06   0.10
    12   1    -0.02   0.06   0.03     0.03  -0.09  -0.03     0.04  -0.11  -0.02
    13   1    -0.21   0.15  -0.06     0.05  -0.04   0.03     0.00   0.01  -0.00
    14   1    -0.36   0.14  -0.03    -0.13   0.06  -0.03     0.11  -0.02   0.03
    15   6     0.03   0.02  -0.00     0.02   0.01  -0.00    -0.01  -0.02   0.02
    16   6     0.02   0.02   0.01     0.01  -0.01   0.00    -0.01  -0.01   0.01
    17   1    -0.16  -0.21   0.04    -0.26  -0.28  -0.33     0.32   0.23   0.31
    18   1    -0.03   0.19  -0.03     0.06  -0.04  -0.13    -0.04  -0.04   0.07
    19   1     0.01   0.01   0.09     0.00   0.01   0.05     0.05  -0.06   0.04
    20   1    -0.00  -0.07   0.11    -0.00  -0.05   0.08     0.01   0.04  -0.05
    21   1    -0.08   0.02   0.01    -0.04   0.01   0.04     0.02  -0.01  -0.04
    22   1    -0.05  -0.08  -0.02    -0.02  -0.06   0.01     0.01   0.07  -0.02
    23   1     0.03  -0.02  -0.01     0.04   0.03   0.01     0.01   0.02   0.01
    24   1     0.01  -0.03   0.02     0.03   0.02   0.01    -0.01   0.05  -0.02
    25   1     0.05   0.01   0.03     0.01  -0.01   0.01     0.02  -0.01  -0.04
    26   1    -0.24   0.47   0.21     0.12  -0.39  -0.24    -0.01   0.04   0.00
                     46                     47                     48
                      A                      A                      A
 Frequencies --   1405.5161              1423.6932              1456.8154
 Red. masses --      1.2580                 1.2170                 1.1947
 Frc consts  --      1.4642                 1.4534                 1.4939
 IR Inten    --      6.2356                 6.7113                 1.9831
 RamAct Fr= 1--      0.2042                 0.3713                35.6864
  Dep-P Fr= 1--      0.3982                 0.0756                 0.3432
  Dep-U Fr= 1--      0.5696                 0.1406                 0.5110
 Alpha2 Fr= 1--      0.0015                 0.0069                 0.3202
 Beta2  Fr= 1--      0.0194                 0.0087                 3.0394
 AlphaG Fr= 1--     -0.0024                 0.0079                -0.1431
 Gamma2 Fr= 1--      0.1511                -0.1005                -0.6353
 Delta2 Fr= 1--      0.0331                 0.0073                 0.1761
 Raman1 Fr= 1--       0.817                  1.485                142.746
 ROA1   Fr= 1--      15.562                 -9.416                -55.357
 CID1   Fr= 1--      19.050                 -6.340                 -0.388
 Raman2 Fr= 1--       0.233                  0.104                 36.473
 ROA2   Fr= 1--       3.361                 -2.470                -16.656
 CID2   Fr= 1--      14.444                -23.663                 -0.457
 Raman3 Fr= 1--       0.465                  0.209                 72.946
 ROA3   Fr= 1--      15.562                 -9.416                -55.357
 CID3   Fr= 1--      33.444                -45.095                 -0.759
 RC180  Fr= 1--       0.139                 -0.719                  0.022
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.02   0.03   0.01
     2   6    -0.00   0.00   0.01    -0.01   0.01   0.00    -0.01  -0.00  -0.01
     3   6    -0.00   0.00   0.00    -0.00   0.00  -0.00     0.07  -0.08   0.00
     4   6     0.00   0.00   0.00     0.00   0.00   0.00     0.02  -0.03  -0.00
     5   6    -0.01   0.00  -0.01    -0.01  -0.00   0.00    -0.04   0.02  -0.02
     6   6     0.02  -0.01   0.03     0.01   0.00   0.01     0.00   0.00   0.01
     7   6    -0.01  -0.00  -0.01    -0.01  -0.01  -0.00     0.00  -0.00   0.00
     8   6     0.01  -0.00   0.01     0.00   0.01  -0.01     0.00   0.00   0.00
     9   1    -0.01   0.00   0.01     0.01   0.01  -0.00     0.11  -0.09  -0.10
    10   1     0.01  -0.00  -0.03     0.05  -0.01  -0.01     0.04  -0.01   0.01
    11   1     0.03  -0.02   0.01     0.01  -0.02   0.00     0.03   0.00   0.00
    12   1     0.01  -0.02  -0.01     0.01  -0.03  -0.00    -0.12   0.64   0.20
    13   1     0.01  -0.01   0.00     0.02  -0.00   0.00    -0.58   0.27  -0.19
    14   1     0.03  -0.01   0.00     0.04   0.01  -0.02     0.15  -0.07   0.05
    15   6    -0.01   0.04  -0.09    -0.00   0.04  -0.09     0.00   0.00  -0.00
    16   6    -0.10  -0.02  -0.03     0.08   0.02   0.02     0.00  -0.00  -0.00
    17   1     0.03   0.03   0.03     0.05   0.05   0.01    -0.00  -0.00  -0.00
    18   1     0.03   0.02  -0.02    -0.04  -0.04   0.05     0.00  -0.05   0.01
    19   1    -0.04   0.01  -0.06     0.05  -0.01   0.06     0.00   0.00   0.01
    20   1    -0.11  -0.17   0.28    -0.11  -0.17   0.29    -0.00   0.01   0.00
    21   1     0.03  -0.00   0.39    -0.02   0.01   0.44    -0.02   0.00   0.02
    22   1     0.15  -0.27   0.26     0.13  -0.33   0.27     0.00  -0.02   0.01
    23   1     0.36   0.17  -0.04    -0.33  -0.15   0.03    -0.01   0.01   0.01
    24   1     0.29   0.18   0.25    -0.27  -0.20  -0.22     0.00   0.01  -0.01
    25   1     0.41  -0.07   0.11    -0.38   0.07  -0.07    -0.00  -0.00   0.00
    26   1    -0.01   0.01  -0.00     0.01   0.00   0.00     0.10  -0.04   0.04
                     49                     50                     51
                      A                      A                      A
 Frequencies --   1478.3650              1485.1541              1487.0037
 Red. masses --      1.0766                 1.0508                 1.0557
 Frc consts  --      1.3863                 1.3656                 1.3753
 IR Inten    --      3.6404                 3.0541                 2.3279
 RamAct Fr= 1--      7.2288                 7.3799                 1.7235
  Dep-P Fr= 1--      0.5572                 0.7466                 0.7460
  Dep-U Fr= 1--      0.7156                 0.8549                 0.8546
 Alpha2 Fr= 1--      0.0265                 0.0004                 0.0001
 Beta2  Fr= 1--      0.8622                 1.0515                 0.2455
 AlphaG Fr= 1--     -0.0041                 0.0038                 0.0015
 Gamma2 Fr= 1--     -0.9237                -0.1569                -0.2491
 Delta2 Fr= 1--      1.9063                -2.8582                 0.0838
 Raman1 Fr= 1--      28.915                 29.519                  6.894
 ROA1   Fr= 1--     -27.671               -106.528                -21.230
 CID1   Fr= 1--      -0.957                 -3.609                 -3.080
 Raman2 Fr= 1--      10.346                 12.618                  2.946
 ROA2   Fr= 1--     -37.419                 19.099                 -6.648
 CID2   Fr= 1--      -3.617                  1.514                 -2.257
 Raman3 Fr= 1--      20.692                 25.236                  5.891
 ROA3   Fr= 1--     -27.671               -106.528                -21.230
 CID3   Fr= 1--      -1.337                 -4.221                 -3.604
 RC180  Fr= 1--       0.431                  0.710                  0.709
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.06  -0.02  -0.01    -0.03  -0.01  -0.00    -0.01   0.00   0.00
     2   6    -0.01   0.01   0.01    -0.00  -0.01  -0.01    -0.00   0.02   0.01
     3   6    -0.02   0.00  -0.00    -0.00   0.00  -0.00    -0.01  -0.00  -0.01
     4   6    -0.00   0.01   0.00    -0.00   0.00   0.00     0.00  -0.00   0.00
     5   6     0.01  -0.00   0.00     0.00   0.00  -0.00     0.00   0.00   0.01
     6   6     0.00  -0.00   0.01    -0.01  -0.01  -0.00    -0.01   0.00  -0.02
     7   6     0.00   0.01   0.01     0.01   0.00   0.00     0.00  -0.00   0.00
     8   6    -0.00   0.01  -0.02    -0.00   0.00  -0.01    -0.00  -0.01   0.02
     9   1     0.42   0.31  -0.29     0.18   0.13  -0.12     0.06   0.04  -0.04
    10   1     0.03  -0.04  -0.19    -0.01   0.01   0.09     0.06  -0.03  -0.17
    11   1    -0.04  -0.20  -0.02     0.02   0.08   0.01    -0.03  -0.17  -0.02
    12   1     0.01  -0.07  -0.03     0.01  -0.03  -0.01     0.00   0.00   0.00
    13   1     0.06  -0.03   0.02     0.03  -0.01   0.01    -0.02   0.01  -0.00
    14   1    -0.03   0.01  -0.01    -0.02   0.00   0.00     0.01   0.00   0.01
    15   6     0.00   0.01   0.01    -0.00  -0.03  -0.02    -0.04   0.00  -0.00
    16   6    -0.00  -0.01   0.00    -0.01   0.03   0.01     0.01   0.01  -0.03
    17   1    -0.02  -0.01  -0.02    -0.01  -0.01  -0.01     0.01   0.00   0.01
    18   1    -0.10  -0.08   0.10    -0.02  -0.04   0.02     0.07   0.08  -0.08
    19   1     0.09  -0.02   0.12     0.02  -0.00   0.03    -0.08   0.02  -0.12
    20   1     0.08  -0.11  -0.13    -0.19   0.34   0.30    -0.04  -0.29   0.16
    21   1     0.02   0.00   0.10    -0.13   0.01  -0.25     0.46  -0.06  -0.09
    22   1    -0.14  -0.08  -0.09     0.34   0.17   0.23     0.13   0.32  -0.02
    23   1    -0.07   0.06   0.05     0.20  -0.31  -0.18     0.17   0.21   0.03
    24   1    -0.00   0.13  -0.07     0.13  -0.18   0.25    -0.10  -0.36   0.06
    25   1     0.11  -0.02  -0.02    -0.16   0.04  -0.17    -0.20   0.01   0.42
    26   1     0.47  -0.02   0.39     0.20  -0.01   0.16     0.06  -0.00   0.05
                     52                     53                     54
                      A                      A                      A
 Frequencies --   1502.6174              1505.2099              1515.4785
 Red. masses --      1.0715                 1.0673                 1.0670
 Frc consts  --      1.4254                 1.4248                 1.4438
 IR Inten    --      6.1075                 5.9165                 5.1318
 RamAct Fr= 1--      7.6454                 2.8605                 2.9022
  Dep-P Fr= 1--      0.7480                 0.6872                 0.6835
  Dep-U Fr= 1--      0.8558                 0.8146                 0.8120
 Alpha2 Fr= 1--      0.0003                 0.0032                 0.0034
 Beta2  Fr= 1--      1.0905                 0.3884                 0.3928
 AlphaG Fr= 1--     -0.0037                 0.0026                -0.0214
 Gamma2 Fr= 1--     -1.8438                 2.6854                 1.7620
 Delta2 Fr= 1--      0.4460                 0.5172                 0.4581
 Raman1 Fr= 1--      30.582                 11.442                 11.609
 ROA1   Fr= 1--    -162.728                274.351                183.811
 CID1   Fr= 1--      -5.321                 23.978                 15.834
 Raman2 Fr= 1--      13.086                  4.660                  4.713
 ROA2   Fr= 1--     -47.818                 60.312                 38.623
 CID2   Fr= 1--      -3.654                 12.941                  8.195
 Raman3 Fr= 1--      26.172                  9.321                  9.426
 ROA3   Fr= 1--    -162.728                274.351                183.811
 CID3   Fr= 1--      -6.218                 29.435                 19.500
 RC180  Fr= 1--       0.712                  0.629                  0.624
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00    -0.02  -0.01  -0.00    -0.00  -0.01  -0.00
     2   6     0.01  -0.02  -0.02    -0.00  -0.03  -0.03     0.00  -0.03  -0.03
     3   6     0.00   0.00   0.00    -0.00  -0.00  -0.00     0.00   0.01   0.00
     4   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00    -0.00  -0.00  -0.00
     5   6     0.01  -0.00  -0.00    -0.00   0.00   0.01     0.00  -0.01  -0.01
     6   6    -0.02  -0.03   0.01     0.02   0.00  -0.03    -0.01   0.03   0.01
     7   6     0.00   0.01  -0.00    -0.00  -0.00  -0.00     0.00  -0.00  -0.00
     8   6     0.00   0.02  -0.03    -0.00  -0.00   0.01    -0.00   0.02  -0.03
     9   1     0.00   0.01  -0.00     0.10   0.07  -0.07     0.00   0.01  -0.01
    10   1    -0.07   0.04   0.23    -0.07   0.05   0.35    -0.07   0.06   0.35
    11   1     0.02   0.25   0.02     0.07   0.35   0.04     0.05   0.37   0.03
    12   1    -0.00   0.00  -0.00     0.00  -0.03  -0.01    -0.00   0.01   0.00
    13   1     0.01  -0.00   0.00     0.03  -0.01   0.01     0.00  -0.00   0.00
    14   1    -0.03  -0.01   0.01     0.00   0.01   0.00    -0.01   0.00  -0.01
    15   6    -0.03  -0.01  -0.02     0.02  -0.01   0.01    -0.01   0.02   0.01
    16   6     0.01  -0.03   0.01     0.00  -0.01  -0.03    -0.01   0.02  -0.00
    17   1    -0.03  -0.02  -0.00     0.01   0.01  -0.01    -0.01  -0.02   0.00
    18   1    -0.14  -0.13   0.16     0.03   0.04  -0.03    -0.16  -0.17   0.18
    19   1     0.15  -0.03   0.21    -0.04   0.00  -0.05     0.17  -0.05   0.23
    20   1    -0.12  -0.07   0.28    -0.00   0.24  -0.08     0.12  -0.35  -0.14
    21   1     0.26  -0.03  -0.19    -0.32   0.04   0.02     0.25  -0.03   0.17
    22   1     0.25   0.29   0.09    -0.03  -0.20   0.07    -0.19  -0.01  -0.17
    23   1    -0.26   0.21   0.16     0.08   0.38   0.13     0.23  -0.18  -0.13
    24   1    -0.08   0.31  -0.26    -0.17  -0.21  -0.09     0.11  -0.18   0.23
    25   1     0.26  -0.04   0.01    -0.06  -0.03   0.47    -0.16   0.03  -0.06
    26   1     0.00  -0.00   0.00     0.11   0.00   0.10     0.00   0.00   0.01
                     55                     56                     57
                      A                      A                      A
 Frequencies --   1523.4688              1711.3242              3023.7682
 Red. masses --      1.0841                 5.7703                 1.0391
 Frc consts  --      1.4825                 9.9566                 5.5975
 IR Inten    --      5.9389                33.4783                15.7442
 RamAct Fr= 1--      4.7717               109.4143                12.9028
  Dep-P Fr= 1--      0.5147                 0.1853                 0.4733
  Dep-U Fr= 1--      0.6796                 0.3127                 0.6425
 Alpha2 Fr= 1--      0.0220                 1.5445                 0.0718
 Beta2  Fr= 1--      0.5405                 5.7014                 1.3817
 AlphaG Fr= 1--      0.0200                -0.1251                -0.0318
 Gamma2 Fr= 1--     -1.7985                -3.3577                 0.5339
 Delta2 Fr= 1--     -0.8329                 2.4646                 0.2037
 Raman1 Fr= 1--      19.087                437.657                 51.611
 ROA1   Fr= 1--    -199.311               -243.468                 57.772
 CID1   Fr= 1--     -10.442                 -0.556                  1.119
 Raman2 Fr= 1--       6.486                 68.417                 16.580
 ROA2   Fr= 1--     -36.501               -100.301                 11.184
 CID2   Fr= 1--      -5.628                 -1.466                  0.675
 Raman3 Fr= 1--      12.972                136.835                 33.160
 ROA3   Fr= 1--    -199.311               -243.468                 57.772
 CID3   Fr= 1--     -15.365                 -1.779                  1.742
 RC180  Fr= 1--       0.359                 -0.375                  0.285
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02   0.01   0.00     0.02  -0.06  -0.01    -0.00  -0.00  -0.00
     2   6     0.01   0.02   0.02    -0.00  -0.01  -0.00    -0.00   0.00   0.00
     3   6     0.01   0.00   0.00    -0.31   0.39   0.00    -0.00   0.00   0.00
     4   6    -0.00  -0.00  -0.00     0.26  -0.33  -0.00    -0.00  -0.00   0.00
     5   6    -0.00  -0.00  -0.01     0.05  -0.04   0.02    -0.00   0.00   0.00
     6   6     0.01  -0.01  -0.01     0.01  -0.00  -0.01     0.00  -0.00   0.00
     7   6    -0.00   0.01   0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
     8   6     0.00   0.03  -0.06     0.01  -0.00   0.00     0.00  -0.00   0.00
     9   1    -0.12  -0.09   0.09    -0.01   0.16   0.05     0.01  -0.00   0.01
    10   1     0.03  -0.04  -0.28     0.00  -0.01  -0.00    -0.01  -0.03   0.01
    11   1    -0.06  -0.28  -0.03    -0.01   0.01   0.00     0.01   0.00  -0.03
    12   1    -0.00   0.02   0.01     0.16   0.41   0.24    -0.00   0.00  -0.00
    13   1    -0.01   0.00  -0.01    -0.44  -0.05  -0.23     0.00   0.00   0.00
    14   1    -0.01  -0.01  -0.00    -0.17   0.07  -0.06    -0.00  -0.00  -0.00
    15   6     0.01  -0.01   0.00     0.00  -0.00  -0.00     0.01   0.02  -0.03
    16   6    -0.01   0.00  -0.02    -0.00   0.00   0.00    -0.04  -0.02   0.00
    17   1    -0.02   0.00  -0.00     0.00   0.00  -0.00    -0.02   0.02   0.00
    18   1    -0.29  -0.29   0.33     0.01   0.01   0.00    -0.02   0.00  -0.02
    19   1     0.29  -0.07   0.42    -0.01   0.02  -0.01     0.01   0.01  -0.00
    20   1    -0.02   0.19  -0.01    -0.01   0.03  -0.00     0.19   0.04   0.06
    21   1    -0.18   0.02  -0.05    -0.03   0.00  -0.01    -0.05  -0.40  -0.03
    22   1     0.03  -0.05   0.05     0.01  -0.01   0.02    -0.31   0.18   0.30
    23   1     0.16   0.15   0.02     0.00   0.00   0.00     0.04  -0.11   0.26
    24   1    -0.02  -0.16   0.06    -0.01   0.00  -0.01     0.34  -0.18  -0.33
    25   1    -0.04  -0.01   0.24     0.01  -0.00  -0.00     0.04   0.48   0.03
    26   1    -0.14  -0.00  -0.12     0.01  -0.02  -0.01     0.01   0.01  -0.01
                     58                     59                     60
                      A                      A                      A
 Frequencies --   3027.1885              3029.5247              3037.9431
 Red. masses --      1.0689                 1.0400                 1.0667
 Frc consts  --      5.7713                 5.6239                 5.8002
 IR Inten    --      4.7183                50.3511                26.3983
 RamAct Fr= 1--     33.7458               271.8667               137.6335
  Dep-P Fr= 1--      0.1634                 0.0355                 0.2646
  Dep-U Fr= 1--      0.2809                 0.0687                 0.4184
 Alpha2 Fr= 1--      0.5041                 5.5576                 1.5654
 Beta2  Fr= 1--      1.5799                 3.1108                 9.5987
 AlphaG Fr= 1--     -0.8360                -0.2168                -0.1150
 Gamma2 Fr= 1--      4.7742                -2.9852                 8.2707
 Delta2 Fr= 1--     12.3319                 2.5797                -6.2706
 Raman1 Fr= 1--     134.983               1087.467                550.534
 ROA1   Fr= 1--     852.944               -204.030                593.329
 CID1   Fr= 1--       6.319                 -0.188                  1.078
 Raman2 Fr= 1--      18.959                 37.330                115.184
 ROA2   Fr= 1--      15.925                -92.283                248.662
 CID2   Fr= 1--       0.840                 -2.472                  2.159
 Raman3 Fr= 1--      37.918                 74.660                230.369
 ROA3   Fr= 1--     852.944               -204.030                593.329
 CID3   Fr= 1--      22.494                 -2.733                  2.576
 RC180  Fr= 1--      -0.438                 -0.863                 -0.163
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.05   0.03  -0.03    -0.00  -0.00   0.00    -0.02  -0.02   0.02
     2   6    -0.01  -0.03  -0.00     0.00  -0.00  -0.00    -0.00  -0.04  -0.04
     3   6     0.00   0.00   0.00     0.00   0.00   0.00     0.00  -0.00   0.00
     4   6    -0.00   0.00   0.00    -0.00   0.00  -0.00     0.00  -0.00  -0.00
     5   6    -0.00   0.00   0.00     0.00   0.00   0.00     0.00  -0.00  -0.00
     6   6    -0.00   0.00   0.00    -0.00  -0.00   0.00    -0.00   0.00   0.00
     7   6    -0.01   0.01   0.00     0.01  -0.00  -0.00    -0.03   0.02   0.00
     8   6    -0.00  -0.00   0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
     9   1    -0.15   0.05  -0.22     0.00  -0.00   0.00     0.02  -0.01   0.03
    10   1     0.08   0.39  -0.07     0.00   0.01  -0.00     0.11   0.56  -0.11
    11   1    -0.02  -0.02   0.10    -0.01  -0.01   0.05    -0.11  -0.08   0.55
    12   1     0.01   0.00   0.01     0.00   0.00   0.00    -0.00  -0.00  -0.00
    13   1    -0.00  -0.01  -0.01    -0.00  -0.00   0.00     0.00   0.01   0.00
    14   1    -0.00  -0.00  -0.00    -0.01  -0.04  -0.03     0.00   0.01   0.01
    15   6     0.00   0.00   0.00    -0.02  -0.02   0.03     0.00   0.00  -0.00
    16   6    -0.00  -0.00   0.00    -0.03  -0.01   0.00    -0.00  -0.00  -0.00
    17   1     0.08  -0.07  -0.01    -0.06   0.05   0.01     0.32  -0.28  -0.05
    18   1    -0.02  -0.00  -0.02    -0.02  -0.00  -0.02    -0.01  -0.00  -0.01
    19   1     0.07   0.04  -0.03     0.02   0.01  -0.01    -0.03  -0.02   0.01
    20   1    -0.01  -0.00  -0.00    -0.23  -0.04  -0.08    -0.01  -0.00  -0.01
    21   1     0.00  -0.00   0.00     0.06   0.46   0.03    -0.00  -0.03  -0.00
    22   1     0.00  -0.00  -0.00     0.36  -0.21  -0.35    -0.02   0.01   0.02
    23   1     0.00  -0.01   0.02     0.04  -0.10   0.23     0.00  -0.00   0.00
    24   1     0.02  -0.01  -0.02     0.29  -0.15  -0.28     0.01  -0.00  -0.00
    25   1     0.00   0.03   0.00     0.03   0.41   0.02     0.00   0.02   0.00
    26   1    -0.44  -0.45   0.57     0.02   0.02  -0.03     0.20   0.20  -0.26
                     61                     62                     63
                      A                      A                      A
 Frequencies --   3053.9508              3064.3009              3066.5072
 Red. masses --      1.0806                 1.0967                 1.0811
 Frc consts  --      5.9380                 6.0672                 5.9898
 IR Inten    --     83.1359                29.9896                32.1320
 RamAct Fr= 1--    205.8298                74.8272                58.8154
  Dep-P Fr= 1--      0.1684                 0.4328                 0.7260
  Dep-U Fr= 1--      0.2883                 0.6041                 0.8412
 Alpha2 Fr= 1--      3.0356                 0.4909                 0.0243
 Beta2  Fr= 1--      9.8895                 7.5338                 8.2462
 AlphaG Fr= 1--      0.3309                 0.1199                 0.0357
 Gamma2 Fr= 1--      5.2371                10.4131               -24.3018
 Delta2 Fr= 1--      3.2854                19.0170               -13.0041
 Raman1 Fr= 1--     823.319                299.309                235.262
 ROA1   Fr= 1--     607.898               1608.203              -2749.108
 CID1   Fr= 1--       0.738                  5.373                -11.685
 Raman2 Fr= 1--     118.674                 90.406                 98.955
 ROA2   Fr= 1--      99.408                 97.779               -479.211
 CID2   Fr= 1--       0.838                  1.082                 -4.843
 Raman3 Fr= 1--     237.349                180.812                197.910
 ROA3   Fr= 1--     607.898               1608.203              -2749.108
 CID3   Fr= 1--       2.561                  8.894                -13.891
 RC180  Fr= 1--      -0.423                  0.208                  0.682
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.01    -0.03   0.01  -0.04    -0.00   0.00   0.00
     2   6    -0.00   0.02   0.02    -0.02  -0.05   0.05     0.00   0.01  -0.01
     3   6     0.00  -0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00  -0.00
     4   6    -0.00   0.00   0.00     0.00  -0.00   0.00    -0.00   0.00   0.00
     5   6     0.00   0.00   0.00    -0.00  -0.01  -0.01    -0.01  -0.06  -0.04
     6   6    -0.00  -0.00   0.00     0.00   0.00   0.00    -0.00  -0.00   0.00
     7   6    -0.06   0.05   0.01     0.01  -0.01   0.00     0.00  -0.00  -0.00
     8   6    -0.00  -0.01   0.01     0.00   0.00  -0.00    -0.01  -0.02   0.02
     9   1     0.07  -0.01   0.09     0.33  -0.09   0.44     0.01  -0.00   0.01
    10   1    -0.05  -0.25   0.05     0.11   0.55  -0.08    -0.01  -0.07   0.01
    11   1     0.06   0.05  -0.34     0.10   0.06  -0.54    -0.02  -0.01   0.11
    12   1     0.00  -0.00  -0.00    -0.01  -0.00  -0.01     0.01   0.00   0.01
    13   1    -0.00  -0.00  -0.00     0.00   0.00   0.00    -0.01  -0.02  -0.01
    14   1    -0.01  -0.02  -0.01     0.02   0.10   0.08     0.12   0.69   0.52
    15   6    -0.00  -0.00   0.00    -0.00  -0.01  -0.00     0.00   0.00   0.00
    16   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00    -0.00   0.01  -0.00
    17   1     0.65  -0.55  -0.10    -0.08   0.07   0.01    -0.04   0.03   0.01
    18   1    -0.10  -0.00  -0.07     0.02   0.00   0.01    -0.18  -0.01  -0.14
    19   1     0.12   0.08  -0.06    -0.04  -0.03   0.02     0.30   0.20  -0.15
    20   1    -0.01  -0.00  -0.00     0.03   0.01   0.01    -0.02  -0.00  -0.01
    21   1     0.01   0.05   0.00     0.01   0.07   0.00     0.00   0.01   0.00
    22   1     0.03  -0.02  -0.03    -0.01   0.00   0.01     0.01  -0.00  -0.01
    23   1     0.01  -0.01   0.03     0.00  -0.00   0.00     0.01  -0.01   0.03
    24   1     0.01  -0.00  -0.01     0.02  -0.01  -0.02     0.03  -0.01  -0.03
    25   1     0.01   0.06   0.00    -0.00  -0.03  -0.00    -0.00  -0.06  -0.00
    26   1    -0.04  -0.04   0.04     0.00   0.01  -0.02     0.00   0.01  -0.01
                     64                     65                     66
                      A                      A                      A
 Frequencies --   3073.9905              3075.0121              3080.2467
 Red. masses --      1.0994                 1.0747                 1.1001
 Frc consts  --      6.1206                 5.9872                 6.1497
 IR Inten    --      1.0410                24.0052                55.3971
 RamAct Fr= 1--     35.5939               265.6812               140.3419
  Dep-P Fr= 1--      0.1496                 0.0192                 0.7360
  Dep-U Fr= 1--      0.2603                 0.0378                 0.8479
 Alpha2 Fr= 1--      0.5508                 5.6440                 0.0335
 Beta2  Fr= 1--      1.5443                 1.6717                19.8333
 AlphaG Fr= 1--      0.4249                 0.5662                 0.2443
 Gamma2 Fr= 1--      6.5494                 1.9293                 1.1970
 Delta2 Fr= 1--      1.8494                 3.9634                -0.8799
 Raman1 Fr= 1--     142.375               1062.725                561.368
 ROA1   Fr= 1--     687.921                312.039                 86.757
 CID1   Fr= 1--       4.832                  0.294                  0.155
 Raman2 Fr= 1--      18.531                 20.060                238.000
 ROA2   Fr= 1--     142.389                 14.596                 35.768
 CID2   Fr= 1--       7.684                  0.728                  0.150
 Raman3 Fr= 1--      37.062                 40.120                475.999
 ROA3   Fr= 1--     687.921                312.039                 86.757
 CID3   Fr= 1--      18.561                  7.778                  0.182
 RC180  Fr= 1--      -0.479                 -0.924                  0.696
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01  -0.00   0.01    -0.01  -0.00  -0.01     0.00  -0.00   0.01
     2   6     0.00   0.00   0.00     0.00  -0.00  -0.01    -0.00  -0.00   0.01
     3   6     0.00  -0.00   0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
     4   6    -0.00   0.00  -0.00     0.00  -0.00  -0.00    -0.00   0.00   0.00
     5   6    -0.00  -0.00  -0.00     0.00   0.03   0.02    -0.00  -0.01  -0.00
     6   6    -0.00  -0.00   0.00     0.00   0.00  -0.00     0.00  -0.00  -0.00
     7   6    -0.00   0.00   0.00     0.01  -0.01  -0.00     0.00  -0.00  -0.00
     8   6     0.01   0.01  -0.01    -0.03  -0.03   0.04     0.00   0.00  -0.00
     9   1    -0.07   0.02  -0.09     0.09  -0.02   0.12    -0.08   0.02  -0.10
    10   1    -0.01  -0.03   0.00     0.01   0.05  -0.01     0.01   0.03  -0.00
    11   1     0.00   0.00  -0.01    -0.01  -0.01   0.08     0.01   0.01  -0.06
    12   1     0.01   0.00   0.00    -0.01  -0.00  -0.01     0.00   0.00   0.00
    13   1    -0.00  -0.01  -0.00     0.01   0.02   0.01    -0.00  -0.01  -0.00
    14   1     0.01   0.04   0.03    -0.06  -0.34  -0.26     0.01   0.06   0.05
    15   6     0.02  -0.06  -0.03     0.01  -0.02  -0.01     0.02  -0.05  -0.02
    16   6    -0.02   0.05   0.03    -0.00   0.01  -0.00     0.02  -0.06  -0.03
    17   1     0.05  -0.05  -0.01    -0.11   0.09   0.02    -0.01   0.01   0.00
    18   1     0.06   0.00   0.05    -0.25  -0.01  -0.19    -0.00   0.00  -0.00
    19   1    -0.15  -0.10   0.07     0.58   0.40  -0.29    -0.02  -0.01   0.01
    20   1    -0.01  -0.02  -0.01     0.00  -0.00  -0.00    -0.00  -0.01  -0.01
    21   1     0.08   0.53   0.03     0.02   0.14   0.01     0.07   0.49   0.02
    22   1    -0.31   0.16   0.29    -0.12   0.06   0.11    -0.28   0.15   0.27
    23   1    -0.01   0.03  -0.02     0.01  -0.02   0.05     0.01  -0.03   0.03
    24   1     0.32  -0.16  -0.30     0.01  -0.00  -0.01    -0.35   0.17   0.33
    25   1    -0.05  -0.45  -0.02    -0.01  -0.13  -0.01     0.06   0.53   0.02
    26   1     0.00   0.00  -0.00     0.02   0.03  -0.04     0.03   0.02  -0.03
                     67                     68                     69
                      A                      A                      A
 Frequencies --   3082.0770              3106.8518              3124.0599
 Red. masses --      1.0982                 1.0993                 1.0949
 Frc consts  --      6.1464                 6.2516                 6.2962
 IR Inten    --     40.9448                30.7331                20.9817
 RamAct Fr= 1--     98.7900                28.5426                46.2128
  Dep-P Fr= 1--      0.7259                 0.7011                 0.5134
  Dep-U Fr= 1--      0.8412                 0.8243                 0.6785
 Alpha2 Fr= 1--      0.0409                 0.0243                 0.2140
 Beta2  Fr= 1--     13.8499                 3.9214                 5.2259
 AlphaG Fr= 1--      0.2930                 0.0218                 0.0246
 Gamma2 Fr= 1--    -15.4126                 5.2375                -6.3901
 Delta2 Fr= 1--    -25.1180                 6.2994                -0.8316
 Raman1 Fr= 1--     395.160                114.170                184.851
 ROA1   Fr= 1--   -2283.387                704.384               -640.064
 CID1   Fr= 1--      -5.778                  6.170                 -3.463
 Raman2 Fr= 1--     166.199                 47.057                 62.710
 ROA2   Fr= 1--    -168.959                 75.305               -146.711
 CID2   Fr= 1--      -1.017                  1.600                 -2.339
 Raman3 Fr= 1--     332.399                 94.113                125.421
 ROA3   Fr= 1--   -2283.387                704.384               -640.064
 CID3   Fr= 1--      -6.869                  7.484                 -5.103
 RC180  Fr= 1--       0.682                  0.649                  0.357
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.02   0.02  -0.07    -0.00   0.00  -0.00     0.00   0.00  -0.00
     2   6     0.01   0.03  -0.04     0.00   0.00  -0.00     0.00   0.00  -0.01
     3   6    -0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
     4   6     0.00  -0.00   0.00     0.00  -0.00   0.00    -0.00   0.00   0.00
     5   6     0.00  -0.00  -0.00     0.00   0.00   0.00     0.00   0.00  -0.00
     6   6    -0.00  -0.00  -0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
     7   6    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
     8   6     0.00   0.01  -0.01     0.03   0.01   0.01     0.00   0.00   0.00
     9   1     0.44  -0.11   0.58     0.01  -0.00   0.02     0.00  -0.00   0.00
    10   1    -0.06  -0.27   0.04    -0.00  -0.01   0.00    -0.00  -0.02   0.00
    11   1    -0.08  -0.05   0.44    -0.00  -0.00   0.02    -0.01  -0.01   0.06
    12   1    -0.02  -0.00  -0.01    -0.00  -0.00  -0.00     0.01   0.00   0.00
    13   1     0.00   0.01   0.01     0.00   0.00   0.00    -0.00  -0.01  -0.00
    14   1     0.00   0.01   0.00    -0.00  -0.01  -0.01    -0.00   0.00   0.00
    15   6     0.01  -0.01  -0.00    -0.00   0.00  -0.00    -0.08  -0.02  -0.02
    16   6     0.00  -0.01   0.00     0.00   0.04  -0.07     0.00  -0.00   0.00
    17   1     0.01  -0.01  -0.00    -0.00   0.00   0.00    -0.00  -0.00   0.00
    18   1     0.08   0.00   0.06    -0.18  -0.00  -0.15    -0.03  -0.00  -0.03
    19   1    -0.11  -0.07   0.05    -0.16  -0.11   0.09    -0.00  -0.00   0.00
    20   1    -0.03  -0.01  -0.01     0.03   0.00   0.01     0.87   0.16   0.34
    21   1     0.02   0.09   0.00    -0.00  -0.01   0.00     0.01   0.20   0.01
    22   1    -0.07   0.04   0.07     0.00  -0.00  -0.00     0.13  -0.09  -0.15
    23   1    -0.01   0.01  -0.04     0.17  -0.34   0.79    -0.01   0.01  -0.03
    24   1    -0.03   0.01   0.03    -0.16   0.09   0.13     0.01  -0.01  -0.01
    25   1     0.01   0.07   0.00    -0.02  -0.27  -0.03     0.00   0.01   0.00
    26   1    -0.18  -0.17   0.20    -0.01  -0.01   0.02    -0.01  -0.01   0.01
                     70                     71                     72
                      A                      A                      A
 Frequencies --   3130.9059              3132.5168              3208.6358
 Red. masses --      1.0594                 1.0991                 1.1156
 Frc consts  --      6.1187                 6.3542                 6.7668
 IR Inten    --     13.5339                35.1908                14.7400
 RamAct Fr= 1--    137.1617               142.3252                94.1659
  Dep-P Fr= 1--      0.0945                 0.3892                 0.7491
  Dep-U Fr= 1--      0.1726                 0.5603                 0.8566
 Alpha2 Fr= 1--      2.4342                 1.0953                 0.0014
 Beta2  Fr= 1--      3.9458                13.2912                13.4435
 AlphaG Fr= 1--      0.0646                 0.1703                 0.0290
 Gamma2 Fr= 1--      7.2069                -9.1905                 2.5240
 Delta2 Fr= 1--      2.2515                -6.7155                 4.8493
 Raman1 Fr= 1--     548.647                569.301                376.664
 ROA1   Fr= 1--     763.907              -1097.181                397.487
 CID1   Fr= 1--       1.392                 -1.927                  1.055
 Raman2 Fr= 1--      47.350                159.494                161.321
 ROA2   Fr= 1--     154.953               -166.848                 21.782
 CID2   Fr= 1--       3.273                 -1.046                  0.135
 Raman3 Fr= 1--      94.699                318.988                322.643
 ROA3   Fr= 1--     763.907              -1097.181                397.487
 CID3   Fr= 1--       8.067                 -3.440                  1.232
 RC180  Fr= 1--      -0.655                  0.121                  0.713
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
     2   6     0.00   0.00  -0.00     0.00   0.00   0.00    -0.00  -0.00   0.00
     3   6     0.00  -0.01  -0.00    -0.00   0.00   0.00    -0.00  -0.00  -0.00
     4   6    -0.04   0.05  -0.00     0.00  -0.00   0.00    -0.06  -0.05  -0.05
     5   6     0.00   0.00   0.00    -0.00  -0.00  -0.00     0.00  -0.00  -0.00
     6   6    -0.00   0.00  -0.00    -0.00   0.00  -0.00     0.00   0.00  -0.00
     7   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
     8   6    -0.01  -0.00  -0.00    -0.08  -0.02  -0.03    -0.00  -0.00   0.00
     9   1     0.02  -0.00   0.03    -0.01   0.00  -0.01     0.01   0.00   0.01
    10   1    -0.00   0.00   0.00    -0.00  -0.00   0.00     0.00  -0.00  -0.00
    11   1    -0.00  -0.00   0.00     0.00   0.00  -0.01     0.00   0.00  -0.00
    12   1     0.64   0.03   0.34    -0.07  -0.00  -0.03     0.60   0.01   0.31
    13   1    -0.18  -0.57  -0.32     0.02   0.06   0.03     0.17   0.62   0.34
    14   1    -0.00  -0.02  -0.02     0.01   0.05   0.03     0.00   0.01   0.01
    15   6     0.00   0.00   0.00    -0.00  -0.00  -0.00     0.00  -0.00  -0.00
    16   6    -0.00   0.00  -0.00    -0.00   0.01  -0.02     0.00  -0.00  -0.00
    17   1     0.00  -0.00  -0.00     0.04  -0.03  -0.01    -0.00   0.00   0.00
    18   1     0.06   0.00   0.05     0.67   0.02   0.55     0.00   0.00   0.00
    19   1     0.03   0.02  -0.02     0.26   0.19  -0.15     0.00   0.00  -0.00
    20   1    -0.01  -0.00  -0.00     0.05   0.01   0.02    -0.00  -0.00   0.00
    21   1    -0.00  -0.00  -0.00     0.00   0.01   0.00     0.00   0.00   0.00
    22   1    -0.00   0.00   0.00     0.01  -0.01  -0.01    -0.00   0.00   0.00
    23   1     0.01  -0.01   0.03     0.05  -0.11   0.26     0.00  -0.00   0.00
    24   1    -0.01   0.00   0.00    -0.04   0.02   0.03    -0.00   0.00   0.00
    25   1    -0.00  -0.01  -0.00    -0.01  -0.06  -0.01     0.00   0.00   0.00
    26   1     0.01   0.01  -0.01     0.01   0.01  -0.01    -0.00  -0.00   0.00

 -------------------
 - Thermochemistry -
 -------------------
 Temperature   298.150 Kelvin.  Pressure   1.00000 Atm.
 Atom     1 has atomic number  6 and mass  12.00000
 Atom     2 has atomic number  6 and mass  12.00000
 Atom     3 has atomic number  6 and mass  12.00000
 Atom     4 has atomic number  6 and mass  12.00000
 Atom     5 has atomic number  6 and mass  12.00000
 Atom     6 has atomic number  6 and mass  12.00000
 Atom     7 has atomic number  6 and mass  12.00000
 Atom     8 has atomic number  6 and mass  12.00000
 Atom     9 has atomic number  1 and mass   1.00783
 Atom    10 has atomic number  1 and mass   1.00783
 Atom    11 has atomic number  1 and mass   1.00783
 Atom    12 has atomic number  1 and mass   1.00783
 Atom    13 has atomic number  1 and mass   1.00783
 Atom    14 has atomic number  1 and mass   1.00783
 Atom    15 has atomic number  6 and mass  12.00000
 Atom    16 has atomic number  6 and mass  12.00000
 Atom    17 has atomic number  1 and mass   1.00783
 Atom    18 has atomic number  1 and mass   1.00783
 Atom    19 has atomic number  1 and mass   1.00783
 Atom    20 has atomic number  1 and mass   1.00783
 Atom    21 has atomic number  1 and mass   1.00783
 Atom    22 has atomic number  1 and mass   1.00783
 Atom    23 has atomic number  1 and mass   1.00783
 Atom    24 has atomic number  1 and mass   1.00783
 Atom    25 has atomic number  1 and mass   1.00783
 Atom    26 has atomic number  1 and mass   1.00783
 Molecular mass:   136.12520 amu.
 Principal axes and moments of inertia in atomic units:
                           1         2         3
     Eigenvalues --   944.331911390.196371562.83469
           X            0.99966   0.02350   0.01099
           Y           -0.02339   0.99967  -0.01059
           Z           -0.01124   0.01033   0.99988
 This molecule is an asymmetric top.
 Rotational symmetry number  1.
 Warning -- assumption of classical behavior for rotation
           may cause significant error
 Rotational temperatures (Kelvin)      0.09172     0.06230     0.05542
 Rotational constants (GHZ):           1.91113     1.29819     1.15479
 Zero-point vibrational energy     619879.3 (Joules/Mol)
                                  148.15471 (Kcal/Mol)
 Warning -- explicit consideration of  14 degrees of freedom as
           vibrations may cause significant error
 Vibrational temperatures:    153.82   239.68   274.86   303.57   332.68
          (Kelvin)            428.44   516.70   554.20   567.20   604.34
                              656.32   691.04   768.41   886.30   934.66
                             1056.77  1118.88  1150.33  1199.73  1243.57
                             1284.47  1308.85  1322.86  1354.07  1376.84
                             1396.23  1428.03  1456.48  1486.20  1534.58
                             1554.54  1587.02  1629.07  1685.62  1747.80
                             1763.37  1772.08  1791.24  1819.60  1854.42
                             1860.89  1895.74  1909.30  1942.24  1976.69
                             2022.22  2048.38  2096.03  2127.04  2136.81
                             2139.47  2161.93  2165.66  2180.44  2191.93
                             2462.21  4350.53  4355.45  4358.81  4370.92
                             4393.95  4408.85  4412.02  4422.79  4424.26
                             4431.79  4434.42  4470.07  4494.83  4504.68
                             4506.99  4616.51
 
 Zero-point correction=                           0.236100 (Hartree/Particle)
 Thermal correction to Energy=                    0.245687
 Thermal correction to Enthalpy=                  0.246631
 Thermal correction to Gibbs Free Energy=         0.202543
 Sum of electronic and zero-point Energies=           -390.609186
 Sum of electronic and thermal Energies=              -390.599599
 Sum of electronic and thermal Enthalpies=            -390.598655
 Sum of electronic and thermal Free Energies=         -390.642743
 
                     E (Thermal)             CV                S
                      KCal/Mol        Cal/Mol-Kelvin    Cal/Mol-Kelvin
 Total                  154.171             39.692             92.792
 Electronic               0.000              0.000              0.000
 Translational            0.889              2.981             40.637
 Rotational               0.889              2.981             29.108
 Vibrational            152.394             33.730             23.047
 Vibration     1          0.606              1.944              3.324
 Vibration     2          0.624              1.884              2.474
 Vibration     3          0.634              1.852              2.218
 Vibration     4          0.643              1.824              2.035
 Vibration     5          0.653              1.793              1.869
 Vibration     6          0.691              1.678              1.429
 Vibration     7          0.734              1.556              1.126
 Vibration     8          0.754              1.502              1.019
 Vibration     9          0.761              1.483              0.984
 Vibration    10          0.783              1.427              0.892
 Vibration    11          0.814              1.347              0.777
 Vibration    12          0.837              1.294              0.709
 Vibration    13          0.889              1.175              0.578
 Vibration    14          0.976              0.998              0.423
                       Q            Log10(Q)             Ln(Q)
 Total Bot       0.686932D-93        -93.163087       -214.515934
 Total V=0       0.272318D+16         15.435076         35.540576
 Vib (Bot)       0.214610-106       -106.668351       -245.612954
 Vib (Bot)    1  0.191691D+01          0.282602          0.650715
 Vib (Bot)    2  0.121108D+01          0.083172          0.191510
 Vib (Bot)    3  0.104727D+01          0.020059          0.046187
 Vib (Bot)    4  0.940963D+00         -0.026427         -0.060851
 Vib (Bot)    5  0.851348D+00         -0.069893         -0.160934
 Vib (Bot)    6  0.639440D+00         -0.194200         -0.447163
 Vib (Bot)    7  0.510674D+00         -0.291857         -0.672024
 Vib (Bot)    8  0.467690D+00         -0.330042         -0.759950
 Vib (Bot)    9  0.454024D+00         -0.342921         -0.789605
 Vib (Bot)   10  0.418024D+00         -0.378799         -0.872216
 Vib (Bot)   11  0.374048D+00         -0.427073         -0.983372
 Vib (Bot)   12  0.348128D+00         -0.458261         -1.055184
 Vib (Bot)   13  0.298314D+00         -0.525326         -1.209608
 Vib (Bot)   14  0.238398D+00         -0.622697         -1.433813
 Vib (V=0)       0.850770D+02          1.929812          4.443556
 Vib (V=0)    1  0.248105D+01          0.394635          0.908681
 Vib (V=0)    2  0.181023D+01          0.257734          0.593455
 Vib (V=0)    3  0.166051D+01          0.220241          0.507123
 Vib (V=0)    4  0.156556D+01          0.194669          0.448242
 Vib (V=0)    5  0.148732D+01          0.172403          0.396973
 Vib (V=0)    6  0.131172D+01          0.117840          0.271336
 Vib (V=0)    7  0.121469D+01          0.084467          0.194492
 Vib (V=0)    8  0.118464D+01          0.073587          0.169440
 Vib (V=0)    9  0.117538D+01          0.070178          0.161591
 Vib (V=0)   10  0.115172D+01          0.061348          0.141260
 Vib (V=0)   11  0.112443D+01          0.050932          0.117275
 Vib (V=0)   12  0.110926D+01          0.045032          0.103690
 Vib (V=0)   13  0.108223D+01          0.034319          0.079023
 Vib (V=0)   14  0.105393D+01          0.022810          0.052522
 Electronic      0.100000D+01          0.000000          0.000000
 Translational   0.624254D+08          7.795362         17.949484
 Rotational      0.512746D+06          5.709903         13.147536
 ***** Axes restored to original set *****
 -------------------------------------------------------------------
 Center     Atomic                   Forces (Hartrees/Bohr)
 Number     Number              X              Y              Z
 -------------------------------------------------------------------
      1        6           0.000025159    0.000017921   -0.000012380
      2        6          -0.000023889   -0.000003420    0.000008741
      3        6          -0.000037515   -0.000049987    0.000003120
      4        6          -0.000004542    0.000002315   -0.000002472
      5        6           0.000012908   -0.000005662   -0.000013853
      6        6          -0.000024859   -0.000004144    0.000036309
      7        6           0.000031491   -0.000012247    0.000008470
      8        6          -0.000013169    0.000046462    0.000004426
      9        1           0.000002231    0.000002004    0.000003128
     10        1          -0.000000709   -0.000001605   -0.000001808
     11        1          -0.000000548    0.000006995   -0.000004807
     12        1           0.000000252    0.000000639   -0.000000238
     13        1           0.000003325   -0.000001877   -0.000000345
     14        1           0.000001029   -0.000001614   -0.000001692
     15        6          -0.000009989    0.000001984   -0.000007870
     16        6           0.000018141    0.000005119    0.000012653
     17        1           0.000002319    0.000002369    0.000000515
     18        1           0.000004113   -0.000005354   -0.000003459
     19        1           0.000003146    0.000000172    0.000000214
     20        1           0.000015423    0.000002963   -0.000003497
     21        1           0.000002986    0.000000913   -0.000006207
     22        1           0.000001583   -0.000001355   -0.000000782
     23        1           0.000005142   -0.000005839   -0.000003317
     24        1          -0.000004325    0.000001776   -0.000003870
     25        1          -0.000004694    0.000001216   -0.000004207
     26        1          -0.000005010    0.000000254   -0.000006772
 -------------------------------------------------------------------
 Cartesian Forces:  Max     0.000049987 RMS     0.000012927
 End of FrcOut F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.093368
 Property number 1 -- Alpha(-w,w) frequency  1    0.093368:
                 1             2             3 
      1   0.128833D+03 -0.786079D+01  0.386789D+00
      2  -0.786079D+01  0.120183D+03  0.111981D+01
      3   0.386789D+00  0.111981D+01  0.104445D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.093368:
                 1             2             3 
      1   0.420415D+01 -0.350793D+01  0.233606D+01
      2   0.825784D+01  0.236902D+01 -0.775970D+01
      3   0.108536D+02 -0.971532D+01 -0.680944D+01
 Property number 4 -- D-Q polarizability frequency  1    0.093368:
                 1             2             3 
      1   0.123295D+02 -0.316644D+02  0.465418D+01
      2   0.206915D+02 -0.800891D+01 -0.927699D+01
      3  -0.330210D+02  0.396733D+02  0.462280D+01
      4  -0.751977D+02  0.593936D+02  0.132454D+02
      5   0.664644D+01  0.193590D+02 -0.226951D+02
      6   0.984737D+01 -0.469554D+01  0.264521D+00
 End of FrcOut F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    78 ND12= 1 LenFil=    2811:
 Frequencies=    0.093368
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1  -0.185877D+01 -0.212944D+01 -0.177401D+01 -0.985537D+00  0.113103D+01
      2  -0.212944D+01 -0.165956D+01  0.110733D+01  0.113103D+01 -0.400076D+01
      3  -0.177401D+01  0.110733D+01 -0.278540D+01  0.187203D+01  0.119075D+01
                 6             7             8             9            10 
      1   0.187203D+01 -0.337941D+01  0.200165D+01 -0.355209D+01 -0.545410D-01
      2   0.119075D+01  0.200165D+01  0.273123D+01 -0.106461D+01  0.224620D+01
      3  -0.545453D-01 -0.355209D+01 -0.106461D+01 -0.739650D+00  0.160603D+01
                11            12            13            14            15 
      1   0.224620D+01  0.160603D+01  0.185599D+01 -0.324935D+01 -0.162961D+00
      2  -0.334790D+01 -0.854288D-01 -0.324935D+01 -0.676123D+01  0.612896D+00
      3  -0.854288D-01  0.195767D+01 -0.162961D+00  0.612896D+00  0.913191D+00
                16            17            18            19            20 
      1   0.221360D+01  0.129509D+00  0.189268D+01 -0.131139D+02  0.938422D+01
      2   0.129509D+00  0.139543D+01 -0.231938D+00  0.938422D+01 -0.768116D+01
      3   0.189268D+01 -0.231938D+00 -0.578269D+01  0.308179D+01 -0.550428D+00
                21            22            23            24            25 
      1   0.308179D+01  0.890279D+01 -0.776102D+01 -0.131473D+01  0.340253D+00
      2  -0.550428D+00 -0.776102D+01  0.105068D+02 -0.213559D+01  0.418203D+00
      3  -0.137152D+01 -0.131473D+01 -0.213559D+01  0.216433D+01 -0.103966D+01
                26            27            28            29            30 
      1   0.418203D+00 -0.103966D+01  0.688836D+01 -0.656430D+01 -0.553643D+01
      2  -0.184039D+01  0.116142D+01 -0.656430D+01  0.743264D+01  0.253387D+01
      3   0.116142D+01  0.639914D-01 -0.553643D+01  0.253387D+01  0.218621D+01
                31            32            33            34            35 
      1  -0.951446D+01  0.840063D+01  0.473016D+00 -0.667077D+01  0.137936D+01
      2   0.840063D+01 -0.859623D+01  0.394680D+01  0.137936D+01  0.519331D+01
      3   0.473016D+00  0.394680D+01 -0.213427D+01  0.351979D+01 -0.330672D+01
                36            37            38            39            40 
      1   0.351979D+01  0.123834D+02 -0.581534D+01 -0.393982D+01 -0.220965D+01
      2  -0.330672D+01 -0.581534D+01  0.347659D+01 -0.579202D+00  0.267086D+01
      3  -0.794435D+00 -0.393982D+01 -0.579202D+00  0.252451D+01 -0.109769D+01
                41            42            43            44            45 
      1   0.267086D+01 -0.109769D+01 -0.744358D+01  0.361616D+00  0.313497D+01
      2   0.104148D+01  0.554547D+01  0.361616D+00  0.504875D+01  0.106478D+01
      3   0.554547D+01  0.859492D+00  0.313497D+01  0.106478D+01 -0.118817D+01
                46            47            48            49            50 
      1  -0.492559D+01  0.327311D+01  0.599810D+01  0.447410D+01 -0.489935D+01
      2   0.327311D+01 -0.276478D+01  0.937575D-01 -0.489935D+01 -0.728926D+01
      3   0.599810D+01  0.937575D-01 -0.232979D+01 -0.160773D+00 -0.452110D+00
                51            52            53            54            55 
      1  -0.160773D+00  0.117607D+02 -0.198492D+01 -0.274511D+01  0.192768D+01
      2  -0.452110D+00 -0.198492D+01  0.940795D+00  0.241767D+01 -0.327146D+01
      3   0.177020D+01 -0.274511D+01  0.241767D+01 -0.925444D+00 -0.245102D+01
                56            57            58            59            60 
      1  -0.327146D+01 -0.245102D+01 -0.328709D+01  0.611320D+01  0.955924D-01
      2   0.566724D+01 -0.110826D+00  0.611320D+01  0.385642D+01 -0.233534D+01
      3  -0.110826D+00 -0.132677D+01  0.955924D-01 -0.233534D+01  0.168691D+01
                61            62            63            64            65 
      1  -0.242905D+01 -0.661421D+00 -0.145620D+01  0.595667D-01 -0.876975D+00
      2  -0.661421D+00 -0.309620D+01  0.393598D+00 -0.876975D+00 -0.378861D+01
      3  -0.145620D+01  0.393598D+00  0.477363D+01  0.409282D+01  0.255271D+01
                66            67            68            69            70 
      1   0.409282D+01  0.798709D+00 -0.415128D+01  0.319763D+01  0.368180D+01
      2   0.255271D+01 -0.415128D+01  0.389176D+01 -0.130329D+01  0.174260D+01
      3   0.184668D+01  0.319763D+01 -0.130329D+01 -0.273857D+01  0.146484D+01
                71            72            73            74            75 
      1   0.174260D+01  0.146484D+01  0.449018D+01  0.590828D+00  0.264515D+01
      2  -0.273117D+00 -0.222688D+01  0.590828D+00  0.127994D+01  0.449470D+00
      3  -0.222688D+01 -0.120779D+01  0.264515D+01  0.449470D+00  0.243932D+01
                76            77            78            79            80 
      1  -0.677418D+00  0.723380D+00 -0.540641D+00  0.382802D+01  0.199191D+00
      2   0.723380D+00 -0.263528D-02  0.553316D+00  0.199191D+00  0.604864D+00
      3  -0.540641D+00  0.553316D+00 -0.279411D+00  0.327084D+01  0.809858D+00
                81            82            83            84            85 
      1   0.327084D+01  0.909542D+00  0.147742D+01 -0.956413D-01  0.154310D+01
      2   0.809858D+00  0.147742D+01  0.184737D+01  0.209917D+00  0.211584D+01
      3   0.429266D+01 -0.956413D-01  0.209917D+00 -0.103581D+00  0.252612D+00
                86            87            88            89            90 
      1   0.211584D+01  0.252612D+00 -0.655907D+00 -0.218016D+00 -0.167494D-01
      2   0.119636D+02  0.802749D+00 -0.218016D+00 -0.129288D+01  0.119129D+01
      3   0.802749D+00  0.100026D+01 -0.167494D-01  0.119129D+01  0.478979D+00
                91            92            93            94            95 
      1  -0.812002D+00 -0.125669D+00  0.970034D+00 -0.404942D+00 -0.201171D-02
      2  -0.125669D+00  0.403443D-01 -0.278667D+00 -0.201171D-02  0.680051D+00
      3   0.970034D+00 -0.278667D+00 -0.125714D+01  0.303695D-01  0.969314D+00
                96            97            98            99           100 
      1   0.303695D-01  0.130829D+01 -0.157289D-01 -0.907473D+00  0.952112D+01
      2   0.969314D+00 -0.157289D-01  0.161316D+01  0.181197D+01 -0.252443D+01
      3  -0.145418D+00 -0.907473D+00  0.181197D+01  0.863427D+01  0.295889D+01
               101           102           103           104           105 
      1  -0.252443D+01  0.295889D+01 -0.684017D+00  0.156074D+01  0.441416D+00
      2   0.185777D+01 -0.849805D+00  0.156074D+01 -0.160725D+01 -0.243686D+00
      3  -0.849805D+00  0.148332D+01  0.441416D+00 -0.243686D+00  0.180174D-01
               106           107           108           109           110 
      1   0.527618D+01 -0.891679D+00  0.145444D+01  0.105668D+01 -0.123190D+01
      2  -0.891679D+00 -0.545657D-01 -0.145287D-01 -0.123190D+01 -0.837474D+00
      3   0.145444D+01 -0.145287D-01  0.117102D+01  0.170368D+00 -0.107720D+01
               111           112           113           114           115 
      1   0.170368D+00 -0.155984D+01  0.148406D+01  0.445216D+00  0.595834D-01
      2  -0.107720D+01  0.148406D+01 -0.842413D+01 -0.310284D+01 -0.543874D-01
      3  -0.561839D+00  0.445216D+00 -0.310284D+01 -0.182527D+01 -0.243922D+00
               116           117           118           119           120 
      1  -0.543874D-01 -0.243922D+00 -0.600131D+00 -0.954438D+00 -0.463691D+00
      2  -0.415913D+01 -0.161982D+01 -0.954438D+00 -0.814168D+00 -0.391914D+00
      3  -0.161982D+01 -0.142550D+01 -0.463691D+00 -0.391914D+00 -0.706052D+00
               121           122           123           124           125 
      1  -0.165465D+01 -0.511971D+00 -0.470804D+00  0.620077D-01 -0.463799D+00
      2  -0.511971D+00 -0.536667D+01 -0.337021D+01 -0.463799D+00 -0.264940D+01
      3  -0.470804D+00 -0.337021D+01 -0.289806D+01 -0.564879D+00 -0.270657D+01
               126           127           128           129           130 
      1  -0.564879D+00 -0.249889D+01 -0.159618D+01 -0.468384D+01 -0.189993D+01
      2  -0.270657D+01 -0.159618D+01  0.124813D+01  0.176728D+00  0.211275D+01
      3  -0.364974D+01 -0.468384D+01  0.176728D+00  0.217071D+01  0.600124D+00
               131           132           133           134           135 
      1   0.211275D+01  0.600124D+00 -0.473520D+01  0.465149D+00  0.222616D+01
      2   0.680233D+01 -0.844429D+00  0.465149D+00  0.980749D-01 -0.253427D+01
      3  -0.844429D+00 -0.287196D+01  0.222616D+01 -0.253427D+01 -0.201425D+00
               136           137           138           139           140 
      1   0.411254D+00 -0.238047D+01 -0.428065D+01 -0.361912D+01  0.339814D+01
      2  -0.238047D+01  0.132305D+01  0.569088D-01  0.339814D+01  0.674796D+01
      3  -0.428065D+01  0.569088D-01  0.211407D+01  0.278184D+00  0.953490D+00
               141           142           143           144           145 
      1   0.278184D+00 -0.614169D+01  0.916683D+00  0.325932D+01 -0.613472D+01
      2   0.953490D+00  0.916683D+00  0.416219D+00 -0.256368D+01  0.425004D+01
      3  -0.285063D+01  0.325932D+01 -0.256368D+01  0.291050D+01  0.969719D+00
               146           147           148           149           150 
      1   0.425004D+01  0.969719D+00  0.328389D+01 -0.382231D+01 -0.210811D+00
      2  -0.453002D+01 -0.532496D+00 -0.382231D+01  0.531102D+01  0.925948D+00
      3  -0.532496D+00 -0.776640D+00 -0.210811D+00  0.925948D+00  0.740112D+00
               151           152           153           154           155 
      1   0.104633D+01 -0.363466D+00 -0.925433D+00 -0.461393D+01  0.864240D+00
      2  -0.363466D+00  0.112539D+01  0.125676D+01  0.864240D+00 -0.102948D+01
      3  -0.925433D+00  0.125676D+01  0.366746D+00 -0.329286D+01  0.668204D+00
               156           157           158           159           160 
      1  -0.329286D+01 -0.186563D+00 -0.488112D+00  0.371153D-01 -0.289293D+01
      2   0.668204D+00 -0.488112D+00  0.976046D-01 -0.741389D+00  0.558397D+00
      3  -0.396157D+01  0.371153D-01 -0.741389D+00  0.421545D+00 -0.328419D+01
               161           162           163           164           165 
      1   0.558397D+00 -0.328419D+01  0.300388D+01  0.194751D+01 -0.245783D+01
      2  -0.100305D+01  0.117030D+01  0.194751D+01  0.271526D+01 -0.210158D+01
      3   0.117030D+01 -0.549905D+01 -0.245783D+01 -0.210158D+01  0.294103D+01
               166           167           168           169           170 
      1   0.113022D+01  0.194560D+01 -0.125845D+01 -0.123301D+01 -0.107999D+01
      2   0.194560D+01  0.289318D+01 -0.210077D+01 -0.107999D+01 -0.148512D+01
      3  -0.125845D+01 -0.210077D+01  0.247659D+01  0.132403D+01  0.218811D+01
               171           172           173           174           175 
      1   0.132403D+01  0.526496D+01  0.614784D+00  0.172159D+01  0.778048D+00
      2   0.218811D+01  0.614784D+00  0.937624D+00 -0.269309D+00  0.510712D+00
      3  -0.343195D+01  0.172159D+01 -0.269309D+00  0.271006D+01 -0.654457D-01
               176           177           178           179           180 
      1   0.510712D+00 -0.654457D-01  0.152498D+01  0.620133D-01  0.152122D+01
      2  -0.265261D+00  0.417201D+00  0.620133D-01  0.345647D+00  0.183814D+00
      3   0.417201D+00  0.562098D+00  0.152122D+01  0.183814D+00  0.208428D+01
               181           182           183           184           185 
      1  -0.406952D+00 -0.978518D+00  0.718585D+00 -0.136669D+01 -0.178730D+01
      2  -0.978518D+00 -0.940707D+00  0.162478D+00 -0.178730D+01 -0.872345D+01
      3   0.718585D+00  0.162478D+00 -0.579314D+00  0.421617D+00  0.220196D+01
               186           187           188           189           190 
      1   0.421617D+00  0.218293D+00 -0.104196D+00 -0.395845D+00 -0.377891D+01
      2   0.220196D+01 -0.104196D+00  0.226607D-01 -0.772214D+00  0.531054D+00
      3  -0.178915D+01 -0.395845D+00 -0.772214D+00  0.355375D+00  0.349797D+01
               191           192           193           194           195 
      1   0.531054D+00  0.349797D+01  0.150505D+01 -0.957763D+00 -0.117137D+01
      2  -0.107884D+01 -0.188999D+00 -0.957763D+00  0.232607D+00  0.103680D+01
      3  -0.188999D+00 -0.412481D+01 -0.117137D+01  0.103680D+01  0.229573D+01
               196           197           198           199           200 
      1   0.257008D+01 -0.258639D+00 -0.317320D+01 -0.136527D+01  0.814925D+00
      2  -0.258639D+00  0.680284D+00  0.775325D+00  0.814925D+00 -0.331049D+00
      3  -0.317320D+01  0.775325D+00  0.563610D+01 -0.125642D+01  0.302151D+00
               201           202           203           204           205 
      1  -0.125642D+01  0.176242D+01 -0.697757D+00  0.560677D+00 -0.257857D+01
      2   0.302151D+00 -0.697757D+00  0.367237D+00 -0.117886D+01  0.491274D-01
      3  -0.162879D+01  0.560677D+00 -0.117886D+01  0.171921D+01 -0.271542D+01
               206           207           208           209           210 
      1   0.491274D-01 -0.271542D+01 -0.743410D+01  0.107783D+01  0.271891D+01
      2  -0.131639D+01  0.135283D+01  0.107783D+01 -0.919017D+00 -0.462006D+00
      3   0.135283D+01 -0.575238D+01  0.271891D+01 -0.462006D+00 -0.179436D+01
               211           212           213           214           215 
      1   0.319203D+01 -0.174061D+01 -0.831051D+00  0.578780D+01 -0.581920D+00
      2  -0.174061D+01  0.329549D+00  0.584869D+00 -0.581920D+00  0.920694D+00
      3  -0.831051D+00  0.584869D+00  0.108049D+01 -0.280414D+01  0.742510D+00
               216           217           218           219           220 
      1  -0.280414D+01 -0.123886D+01 -0.108635D+01  0.206039D+00 -0.318263D+01
      2   0.742510D+00 -0.108635D+01 -0.906664D+00 -0.924678D-01 -0.368115D+01
      3   0.226767D+01  0.206039D+00 -0.924678D-01 -0.199881D+00 -0.511118D+00
               221           222           223           224           225 
      1  -0.368115D+01 -0.511118D+00  0.421909D+00 -0.258083D+00 -0.904510D+00
      2  -0.828209D+01 -0.761252D+00 -0.258083D+00 -0.471176D+00 -0.799893D+00
      3  -0.761252D+00 -0.990638D+00 -0.904510D+00 -0.799893D+00 -0.494695D+00
               226           227           228           229           230 
      1   0.291995D+01  0.246329D+01 -0.112378D+01  0.200618D+01  0.158303D+01
      2   0.246329D+01  0.280349D+01 -0.743187D+00  0.158303D+01  0.459741D+01
      3  -0.112378D+01 -0.743187D+00  0.113389D+01 -0.909757D+00 -0.117180D+01
               231           232           233           234 
      1  -0.909757D+00 -0.193973D+01 -0.134725D+01  0.166054D+01
      2  -0.117180D+01 -0.134725D+01 -0.349510D+01  0.132089D+01
      3   0.869755D+00  0.166054D+01  0.132089D+01 -0.194229D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1   0.179003D+01 -0.165329D+01  0.325363D+01  0.686291D+00 -0.352446D+01
      2  -0.679563D+01  0.731028D+01 -0.484415D+01  0.627319D+01  0.490595D+01
      3   0.858036D+01 -0.818798D+01 -0.718851D+01 -0.242425D+01  0.613745D+01
                 6             7             8             9            10 
      1  -0.105411D+01  0.392532D+01  0.956136D+01  0.242985D+01 -0.178921D+01
      2  -0.412620D+00 -0.102662D+02 -0.615939D+01 -0.466833D+00  0.207587D+01
      3  -0.154511D+01 -0.100839D+02 -0.297160D+01 -0.286328D+01 -0.909032D+00
                11            12            13            14            15 
      1  -0.316384D+01 -0.415388D+01 -0.300375D+01 -0.111115D+02 -0.406457D+01
      2  -0.229215D+01  0.475381D+00 -0.314605D+01  0.233707D+01  0.564064D+00
      3   0.753942D+01  0.476963D+01  0.116685D+02 -0.525642D+01 -0.334561D+00
                16            17            18            19            20 
      1  -0.518400D+01  0.543057D+01  0.152864D+02 -0.260385D+01  0.180814D+01
      2  -0.481065D+01  0.709531D+00 -0.533399D+01  0.116782D+01  0.610308D+01
      3   0.636142D+01  0.298517D+00  0.310723D+01  0.396586D+01 -0.287708D+01
                21            22            23            24            25 
      1  -0.517772D+01 -0.644609D+00 -0.864996D+01  0.581106D+01 -0.907621D+01
      2  -0.391271D+01  0.374970D+01 -0.699709D+01  0.660971D+01 -0.145664D+02
      3  -0.377779D+01  0.118802D+02 -0.169122D+02  0.674050D+01  0.850946D+00
                26            27            28            29            30 
      1   0.143153D+02  0.184691D+01 -0.808841D+01 -0.298871D-01  0.436330D+01
      2   0.822325D+01 -0.193260D+01 -0.737502D+01  0.422538D+01  0.569205D+01
      3   0.318903D+01 -0.327122D+00  0.864555D+01 -0.130747D+02  0.323437D+01
                31            32            33            34            35 
      1  -0.393882D+01  0.107759D+02 -0.732825D+01  0.153093D+01 -0.439924D+00
      2  -0.327572D+01  0.150095D+02 -0.689153D+01 -0.133548D+01 -0.436194D+01
      3  -0.809516D+00  0.424092D+01 -0.113924D+02  0.891556D+01 -0.172233D+02
                36            37            38            39            40 
      1   0.329104D+01 -0.715880D+00 -0.175586D+01  0.260349D+01 -0.464504D+01
      2  -0.191964D+01  0.118649D+02 -0.739205D+01 -0.215496D+01 -0.358850D+01
      3   0.230926D+01 -0.258178D+01 -0.822817D-01  0.126484D+01  0.866928D+01
                41            42            43            44            45 
      1   0.767107D+01 -0.921195D+01  0.668460D+01 -0.444764D+01 -0.215886D+01
      2   0.363129D+01 -0.181533D+01 -0.163663D+02  0.420283D+01  0.412476D+01
      3  -0.474205D+01 -0.162574D+01  0.260042D+01  0.533265D+00 -0.221335D+01
                46            47            48            49            50 
      1   0.369389D+01 -0.353733D+00 -0.157788D+01 -0.176650D+01 -0.396443D+01
      2  -0.143037D+02  0.132105D+01  0.928951D+01  0.363361D+01 -0.102409D+01
      3   0.422555D+01 -0.105475D+02 -0.180809D+01 -0.121790D+01 -0.135863D+02
                51            52            53            54            55 
      1  -0.175028D+01 -0.383854D+01  0.816504D+01  0.546498D+00  0.350079D+01
      2  -0.371628D+01  0.428396D+01 -0.749364D+01  0.359795D+01  0.249820D+01
      3  -0.139553D+01 -0.546604D+01  0.107977D+01  0.736503D+01 -0.286323D+01
                56            57            58            59            60 
      1   0.148854D+01  0.520238D+01  0.223550D+01  0.430309D+01 -0.494991D+01
      2   0.239881D+01  0.409412D+01  0.140701D+01  0.208977D+01 -0.146924D+01
      3  -0.451260D+01 -0.405012D+01  0.352153D+01  0.134393D+02 -0.202906D+01
                61            62            63            64            65 
      1   0.312177D+01  0.229736D+01 -0.112672D+02 -0.171361D+01  0.352013D+01
      2  -0.149702D+01 -0.236669D+01 -0.561425D+01 -0.168854D+01 -0.536242D+01
      3  -0.531433D+01 -0.393113D+01 -0.319728D+01  0.133300D+01 -0.715125D+01
                66            67            68            69            70 
      1  -0.100474D+02  0.678210D+01 -0.852656D+01  0.410995D+01 -0.725909D+01
      2   0.115780D+02 -0.267349D+01 -0.703436D+01  0.889140D+01  0.411806D+01
      3   0.755433D+01 -0.163432D+01 -0.835743D+00  0.299003D+01  0.522315D+01
                71            72            73            74            75 
      1   0.726487D+01  0.841554D+01 -0.301037D+01  0.543051D+00 -0.295939D+01
      2   0.684651D+01  0.654109D+01  0.277056D+01  0.148094D+01  0.609118D+01
      3   0.163693D+01  0.170981D+01  0.388559D+01 -0.379720D+01  0.228224D+01
                76            77            78            79            80 
      1   0.287229D+00 -0.561931D-01 -0.122491D+00 -0.316279D+01  0.109813D+01
      2  -0.592850D+00  0.566509D+00 -0.779204D+00  0.316192D+01  0.205855D+01
      3  -0.320401D+00  0.208640D+01 -0.114471D+01  0.463290D+01 -0.232836D+01
                81            82            83            84            85 
      1  -0.446099D+01  0.168889D+01  0.188456D+01  0.913747D-01  0.124131D+01
      2   0.903740D+01 -0.995618D+00 -0.110199D+01  0.143000D+01 -0.171023D+01
      3   0.252771D+01  0.205358D+01  0.218274D+00 -0.656660D+00  0.554079D+01
                86            87            88            89            90 
      1   0.960826D+01 -0.467192D+01  0.140491D+00 -0.230313D+01  0.208705D+00
      2  -0.145518D+01  0.870020D+00 -0.663467D-01  0.464759D+00  0.161257D+00
      3  -0.273273D+01  0.428906D+00 -0.189244D+01  0.606985D+00 -0.580503D+00
                91            92            93            94            95 
      1  -0.251060D+01 -0.449025D+00  0.279535D+01 -0.671191D+00 -0.158955D+01
      2   0.140805D+01  0.504607D+00 -0.774880D+00  0.118015D+01  0.615485D+00
      3  -0.230526D+01 -0.222255D+01  0.177419D+01 -0.613209D+00  0.105999D+01
                96            97            98            99           100 
      1   0.137791D+01  0.251311D+01  0.166660D+01 -0.180044D+02  0.757699D+01
      2  -0.490264D+00 -0.533157D+01  0.711191D+00  0.565555D+01  0.106534D+02
      3  -0.542145D+00  0.367004D+01 -0.701203D+00 -0.215031D+01 -0.110120D+02
               101           102           103           104           105 
      1  -0.116021D+01  0.341906D+01  0.230604D+00  0.319505D+00 -0.151700D+00
      2  -0.476564D+01  0.822349D+01  0.115308D+01 -0.124428D+01  0.470285D+00
      3  -0.316298D+01 -0.365012D+01 -0.142102D+01  0.947904D+00  0.434120D-02
               106           107           108           109           110 
      1   0.344481D+01  0.766042D+00  0.180467D+01  0.195098D+01 -0.185937D+01
      2   0.262382D+01  0.200853D+01  0.522552D+01 -0.116922D+00 -0.277005D+01
      3  -0.866924D+01  0.119858D+01 -0.197442D+01  0.269952D+01  0.357446D+01
               111           112           113           114           115 
      1  -0.176732D+01  0.143300D+01 -0.270484D+01 -0.539550D+01 -0.199808D+01
      2  -0.811191D+00 -0.126011D+01 -0.723179D+01 -0.384806D+01 -0.921314D+00
      3   0.248832D+01  0.191902D+01  0.195269D+02  0.786409D+01  0.947078D+00
               116           117           118           119           120 
      1   0.109970D+01 -0.354302D+01  0.698773D+00  0.595817D+00 -0.134675D+00
      2  -0.495434D+01 -0.277247D+01 -0.492924D+00 -0.661963D+00  0.749162D+00
      3   0.120598D+02  0.421385D+01  0.727784D-01 -0.705293D+00 -0.718704D-01
               121           122           123           124           125 
      1  -0.335194D+00  0.573957D+01 -0.106840D+01 -0.174813D-01  0.331379D+01
      2  -0.289398D+01 -0.232144D+00  0.271644D+00 -0.247429D+01 -0.492318D+00
      3   0.486584D+01 -0.177604D-01  0.143652D+00  0.126690D+01  0.129979D+00
               126           127           128           129           130 
      1  -0.909739D+00 -0.906991D+01  0.200317D+01  0.279400D+01  0.591910D+01
      2  -0.426635D+00  0.136187D+02  0.119787D+01  0.100499D+02  0.232518D+01
      3   0.201099D+00  0.231420D+01  0.125079D+01  0.685074D+01  0.603874D+01
               131           132           133           134           135 
      1   0.147599D+02 -0.898451D+01  0.317687D+01 -0.484348D+00 -0.633756D+01
      2  -0.220081D+01  0.249857D+01  0.507193D+01  0.314390D+01 -0.399367D+01
      3   0.724386D+01 -0.120118D+01  0.669765D+01  0.827662D-01 -0.580102D+01
               136           137           138           139           140 
      1  -0.222435D+01 -0.796629D-01  0.259605D+01 -0.122852D+01 -0.151497D+01
      2   0.121341D+02 -0.190155D+01 -0.802384D+01 -0.307960D+01 -0.191648D+01
      3  -0.832153D+01  0.529663D+01  0.341265D+01  0.152983D+02  0.200729D+02
               141           142           143           144           145 
      1  -0.521486D+01  0.415219D+01 -0.908292D+00  0.418146D+01 -0.162485D+01
      2   0.938341D+01 -0.191295D+02  0.898028D+01 -0.108435D+02 -0.481757D-02
      3   0.347307D+01  0.394069D+01  0.280011D+01 -0.117544D+02 -0.732558D+01
               146           147           148           149           150 
      1   0.255245D+00  0.296837D+01  0.397827D+00 -0.143865D+01 -0.399666D+01
      2   0.554205D+00  0.324873D+01 -0.483380D+00 -0.568756D+00 -0.225334D+01
      3  -0.856979D+00  0.938365D+00  0.458010D+01  0.234030D+00  0.247142D+00
               151           152           153           154           155 
      1   0.178915D+01 -0.785843D+00 -0.610232D+00  0.302726D+01  0.292044D+01
      2  -0.240476D+00 -0.124541D+01 -0.528851D+00 -0.100049D+02  0.296497D+00
      3   0.167644D+01  0.107994D+01 -0.191722D+00 -0.598406D+01 -0.181704D+01
               156           157           158           159           160 
      1   0.410388D+01  0.109364D+01  0.141055D+01 -0.468954D+00  0.338740D+01
      2  -0.266853D+01 -0.549688D+00 -0.715143D+00 -0.674519D+00 -0.642899D+01
      3  -0.329559D+01  0.895798D+00 -0.150482D+00 -0.403241D+00 -0.329897D+01
               161           162           163           164           165 
      1   0.241572D+01  0.353656D+01 -0.169080D+01 -0.462405D+01 -0.402025D+00
      2  -0.232716D+00 -0.234349D+01  0.956484D+01  0.488074D+01 -0.393042D+01
      3  -0.110814D+01 -0.313076D+01  0.580983D+01  0.172427D+01 -0.336981D+01
               166           167           168           169           170 
      1  -0.232369D+01 -0.385893D+01 -0.130610D+01  0.321768D+00  0.226521D+01
      2   0.434034D+01  0.492424D+01 -0.306404D+01 -0.455335D+01 -0.314682D+01
      3   0.455553D+01  0.205681D+01 -0.225857D+01 -0.271750D+01 -0.540471D+00
               171           172           173           174           175 
      1   0.508295D-01  0.419984D+01  0.348146D+01  0.230284D+01  0.232582D+01
      2   0.293606D+01 -0.181626D+02 -0.174073D+01 -0.350877D+01 -0.203777D+01
      3   0.232251D+01 -0.720574D+01 -0.211529D+01 -0.254281D+01  0.599673D+00
               176           177           178           179           180 
      1   0.101562D+01  0.305998D+00  0.223923D+01  0.216852D+01  0.234570D+01
      2  -0.177029D+01 -0.716299D+00 -0.641874D+01 -0.813541D+00 -0.413215D+01
      3  -0.107072D+01 -0.901185D-02 -0.241306D+01 -0.773999D+00 -0.154218D+01
               181           182           183           184           185 
      1  -0.115880D+01 -0.173929D+01 -0.585434D+00 -0.317422D+01 -0.160997D+02
      2  -0.830877D+00  0.105329D+01  0.618480D+00  0.272455D+01 -0.309992D+00
      3  -0.135885D+01 -0.107306D+01  0.101389D+00  0.298557D+01 -0.897325D+01
               186           187           188           189           190 
      1  -0.124927D+01 -0.423875D+00  0.519387D+00 -0.129369D+01  0.524322D+01
      2   0.197328D+01 -0.878317D+00  0.310546D+00  0.448262D+00  0.407838D+01
      3   0.238053D+01 -0.109719D+00 -0.251270D+00 -0.227041D+00  0.377909D+01
               191           192           193           194           195 
      1  -0.384416D+01 -0.497895D+01 -0.297554D+01  0.222453D+01  0.334753D+01
      2  -0.115753D+01  0.510760D+00 -0.238689D+01  0.957090D-01 -0.124648D+01
      3  -0.352668D+01 -0.349790D+01 -0.155281D+01  0.142300D+01  0.211041D+01
               196           197           198           199           200 
      1  -0.418735D+01  0.444977D+01  0.738373D+01 -0.163135D+01  0.702657D+00
      2  -0.481223D+01 -0.365810D-01 -0.896202D+00  0.311436D+01 -0.609745D-01
      3  -0.292909D+01  0.215188D+01  0.387431D+01  0.297813D+01 -0.188388D+01
               201           202           203           204           205 
      1  -0.987482D+00  0.453208D+00 -0.169275D+01  0.145661D+01 -0.128501D+01
      2   0.481427D+01  0.690117D+00  0.360425D+01 -0.645062D+01  0.304908D+01
      3   0.156751D+01 -0.114592D+01  0.223302D+01 -0.414566D+01  0.108877D+01
               206           207           208           209           210 
      1   0.452380D+01 -0.526891D+01  0.180072D+01 -0.830192D+00 -0.924087D+00
      2  -0.550226D+01  0.178529D+02 -0.975279D+01  0.175735D+01  0.944259D+01
      3  -0.562025D+01  0.651725D+01  0.830264D+01 -0.617771D+01 -0.312225D+01
               211           212           213           214           215 
      1  -0.352899D+00  0.815998D+00 -0.283641D+00 -0.176634D+01  0.166723D+01
      2   0.321384D+01 -0.228384D+01 -0.442455D+01  0.820037D+01 -0.284903D+01
      3  -0.492964D+01  0.232266D+01  0.213612D+01 -0.440737D+01  0.446963D+01
               216           217           218           219           220 
      1   0.925740D+00  0.548654D+00  0.334943D+00 -0.422437D+00  0.355861D+00
      2  -0.887337D+01 -0.693105D+00  0.155688D-01  0.184139D+01  0.411530D+00
      3   0.413240D+01 -0.286027D+01 -0.354974D+01 -0.553917D+00 -0.488212D+01
               221           222           223           224           225 
      1   0.268227D+01 -0.370417D+01 -0.503142D+00  0.427860D+00 -0.377500D+00
      2   0.112400D+01  0.366216D+01  0.166783D+01  0.150937D+01  0.119533D+01
      3  -0.237115D+02 -0.179024D+01 -0.109947D+01 -0.163387D+01 -0.148490D+01
               226           227           228           229           230 
      1   0.211195D+01  0.200440D+01 -0.237503D+01  0.142518D+01  0.284626D+01
      2  -0.353840D+01 -0.333266D+01  0.470366D+01 -0.342404D+01 -0.391956D+01
      3  -0.198649D+01 -0.237519D+01  0.787551D+00  0.235375D+01 -0.896693D+01
               231           232           233           234 
      1  -0.365507D+01 -0.165749D+01 -0.395392D+01  0.253769D+01
      2   0.305782D+01  0.349855D+01  0.441641D+01 -0.689186D+01
      3   0.149190D+01  0.529174D+00  0.576644D+01 -0.842116D+00
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1  -0.749595D+01 -0.100129D+02 -0.656458D+01 -0.342566D+01 -0.631202D+00
      2   0.672111D+01  0.609646D+01  0.923171D+01  0.134926D+01  0.162623D+01
      3   0.774843D+00  0.391643D+01 -0.266713D+01  0.207641D+01 -0.995027D+00
      4  -0.817189D+01 -0.185354D+02  0.311973D+01 -0.455258D+01 -0.233923D+02
      5  -0.100135D+02  0.994458D+00 -0.172171D+02  0.703121D+01  0.489457D+01
      6  -0.123709D+01  0.766406D+01 -0.262063D+01  0.498294D+01  0.433763D+01
                 6             7             8             9            10 
      1   0.787450D+01 -0.777832D+01  0.812504D+01 -0.137540D+02 -0.558060D+01
      2  -0.259823D+01  0.119489D+02 -0.230638D+00  0.114526D+02  0.514630D+01
      3  -0.527627D+01 -0.417060D+01 -0.789440D+01  0.230142D+01  0.434301D+00
      4   0.776066D+01  0.864291D+01  0.180200D+02 -0.117223D+02 -0.121388D+01
      5   0.116528D+01 -0.215663D+02 -0.542059D+01 -0.941907D+01  0.218036D+01
      6  -0.244236D+01 -0.612734D+01 -0.682262D+01  0.189060D+00  0.743086D+01
                11            12            13            14            15 
      1   0.930628D+01 -0.173230D+01  0.128427D+02  0.219610D+02 -0.263367D+01
      2  -0.136142D+02 -0.446644D+00 -0.155520D+02 -0.449106D+02  0.766645D+00
      3   0.430795D+01  0.217895D+01  0.270927D+01  0.229496D+02  0.186703D+01
      4  -0.239834D+01  0.199585D+01  0.170797D+01 -0.140890D+02 -0.648064D+00
      5   0.122157D+01  0.158076D+01  0.117638D+01 -0.366834D+01  0.583518D+00
      6  -0.177787D+01  0.690393D+01 -0.362250D+01 -0.333931D+01  0.429395D+01
                16            17            18            19            20 
      1  -0.218897D+01 -0.444389D+01  0.150609D+02 -0.170880D+02  0.970517D+01
      2  -0.304642D+01  0.111187D+02  0.816779D+01 -0.805171D+01  0.109369D+02
      3   0.523538D+01 -0.667484D+01 -0.232287D+02  0.251397D+02 -0.206421D+02
      4   0.182013D+01 -0.193023D+01  0.392377D+01  0.545997D+02 -0.371043D+02
      5   0.401849D+01  0.883509D+00  0.306381D+01  0.213587D+02 -0.766850D+01
      6   0.602028D+01  0.152702D+01 -0.178863D+02 -0.110379D+02  0.343962D+01
                21            22            23            24            25 
      1   0.115295D+02  0.207391D+02 -0.177433D+02 -0.883405D+01 -0.124284D+00
      2  -0.693931D+01 -0.473803D+00 -0.714520D+01  0.131687D+02 -0.149355D+01
      3  -0.459024D+01 -0.202653D+02  0.248885D+02 -0.433470D+01  0.161783D+01
      4  -0.825967D+01 -0.454111D+02  0.602946D+02 -0.112478D+01 -0.414104D+01
      5  -0.644649D+01 -0.150396D+02  0.324948D+01  0.122929D+02  0.876237D+01
      6   0.858725D+01  0.650165D+01  0.242828D+01 -0.418067D+01  0.146350D+01
                26            27            28            29            30 
      1  -0.356234D+01 -0.435132D+01  0.558565D+01 -0.110936D+02 -0.223002D+02
      2   0.725713D+01 -0.840361D+01  0.656385D+01 -0.776049D+01  0.133546D+02
      3  -0.369479D+01  0.127549D+02 -0.121495D+02  0.188541D+02  0.894561D+01
      4  -0.332976D+01  0.986874D+01 -0.353568D+02  0.433163D+02  0.207656D+02
      5   0.245335D+01 -0.410126D+01 -0.411740D+02  0.177588D+02  0.144317D+02
      6   0.592275D+01 -0.142836D+01  0.213189D+02 -0.136251D+02 -0.797928D+01
                31            32            33            34            35 
      1  -0.134791D+02  0.205570D+02  0.157306D+02 -0.376472D+02  0.260284D+02
      2  -0.113267D+02  0.570998D+01 -0.206759D+02  0.244054D+02 -0.309272D+02
      3   0.248058D+02 -0.262670D+02  0.494537D+01  0.132418D+02  0.489881D+01
      4   0.517054D+02 -0.510264D+02  0.967451D+01  0.172479D+02  0.123773D+02
      5   0.601791D+01  0.103664D+02 -0.938894D+01  0.246080D+02 -0.193981D+02
      6  -0.409545D+01 -0.203251D+02  0.565957D+01 -0.153433D+02  0.145699D+02
                36            37            38            39            40 
      1   0.360295D+01  0.620171D+01 -0.626836D+01  0.272860D+01 -0.106371D+02
      2  -0.376505D+01  0.504216D+01  0.359559D+00 -0.502793D+01 -0.835985D+00
      3   0.162094D+00 -0.112439D+02  0.590880D+01  0.229933D+01  0.114730D+02
      4  -0.185210D+02 -0.321109D+02  0.104975D+02  0.495901D+01  0.522160D+01
      5  -0.105008D+02 -0.421332D+01  0.427081D+00 -0.370897D+00  0.293131D+01
      6  -0.167481D+01  0.516609D+01 -0.809397D+01 -0.371316D+01 -0.802328D+01
                41            42            43            44            45 
      1   0.249286D+02  0.682966D+01  0.148906D+02  0.471316D+01  0.422343D+01
      2  -0.572292D+01 -0.306163D+01 -0.963293D+01 -0.712926D+01  0.982898D-01
      3  -0.192056D+02 -0.376802D+01 -0.525765D+01  0.241609D+01 -0.432172D+01
      4  -0.925125D+01 -0.153195D+01  0.134803D+02 -0.519837D+01 -0.700978D+01
      5  -0.555602D+01  0.300455D+01 -0.652215D+01  0.317743D+01 -0.138343D+01
      6  -0.289400D+01 -0.200646D+02 -0.199171D+01 -0.160879D+02 -0.138341D+01
                46            47            48            49            50 
      1  -0.144720D+02 -0.539691D+01 -0.133349D+02 -0.209326D+01  0.880286D+00
      2   0.756299D+00  0.284431D+01  0.114854D+02  0.647284D+01 -0.490084D+00
      3   0.137157D+02  0.255260D+01  0.184946D+01 -0.437958D+01 -0.390202D+00
      4   0.389052D+01  0.329901D+01 -0.901272D+01  0.443836D+00  0.198027D+02
      5  -0.139808D+02 -0.151477D+01  0.819782D+01 -0.647487D+00 -0.189973D+01
      6  -0.601689D+01  0.438558D+00  0.401053D+01  0.846141D+00 -0.816187D+01
                51            52            53            54            55 
      1  -0.615842D+01 -0.174905D+02 -0.477000D+01  0.916794D+01 -0.345761D+01
      2  -0.312870D+01  0.133196D+02  0.226103D+01 -0.691130D+01 -0.850080D+01
      3   0.928712D+01  0.417095D+01  0.250896D+01 -0.225664D+01  0.119584D+02
      4  -0.166333D+01 -0.199427D+02 -0.691698D-01  0.240934D+01  0.177437D+02
      5  -0.486217D+01  0.105887D+02 -0.446458D+01  0.224766D+01  0.432841D+01
      6   0.281750D+01  0.439494D+01 -0.862151D+00  0.448509D+00 -0.508137D+01
                56            57            58            59            60 
      1   0.142638D+01  0.374310D+01 -0.253120D+01 -0.135640D+02  0.113571D+01
      2   0.131977D+02 -0.494911D+01  0.105572D+02  0.679824D+01  0.504020D+00
      3  -0.146241D+02  0.120601D+01 -0.802599D+01  0.676577D+01 -0.163973D+01
      4  -0.222502D+02 -0.465932D+01 -0.207361D+02  0.104071D+02  0.584100D+01
      5  -0.327603D+01 -0.631238D+00 -0.573228D+01  0.636953D+01  0.244252D+01
      6  -0.173101D+01 -0.827284D+01  0.681833D+00  0.423770D+01 -0.920325D+00
                61            62            63            64            65 
      1   0.325143D+01  0.414737D+01  0.275585D+01  0.607633D+01  0.972331D+01
      2  -0.236920D+01 -0.957111D+01  0.479874D+01  0.641131D+01 -0.654912D+01
      3  -0.882229D+00  0.542374D+01 -0.755459D+01 -0.124876D+02 -0.317419D+01
      4  -0.155481D+01  0.780216D+01 -0.306506D+01  0.179477D+00 -0.502275D+01
      5   0.104838D+01 -0.353314D+00 -0.120634D+01 -0.508902D+01  0.743078D+01
      6  -0.566000D+01  0.277905D+01  0.111712D+02  0.122068D+02  0.150099D+02
                66            67            68            69            70 
      1  -0.324143D+01  0.157221D+02 -0.104308D+02 -0.143958D+01 -0.233495D+00
      2   0.147530D+02 -0.393827D+01  0.401769D+01 -0.679147D+01  0.120235D+02
      3  -0.115116D+02 -0.117838D+02  0.641311D+01  0.823105D+01 -0.117900D+02
      4   0.732234D+01 -0.332008D+01 -0.400516D+01  0.347536D+01  0.133507D+00
      5  -0.171503D+02  0.211153D+01  0.894641D+01 -0.965424D+01 -0.150637D+02
      6  -0.124705D+01  0.136549D+02 -0.126734D+02  0.757732D-01  0.209444D+01
                71            72            73            74            75 
      1  -0.540845D+01 -0.586185D+01  0.235085D+02  0.242506D+01  0.114839D+02
      2   0.677582D+00 -0.230321D+01 -0.180888D+02 -0.198164D+01 -0.120942D+02
      3   0.473086D+01  0.816506D+01 -0.541970D+01 -0.443418D+00  0.610357D+00
      4   0.545091D+01  0.282375D+01  0.844702D+01  0.906443D+01  0.551460D+01
      5  -0.285241D+01 -0.539724D+01  0.207908D+02  0.324155D+01  0.182970D+02
      6  -0.308068D+01  0.199154D+01  0.244836D+01  0.142371D+01  0.342263D+01
                76            77            78            79            80 
      1  -0.425194D+01  0.135245D+01 -0.259337D+01  0.137150D+02 -0.467360D+00
      2   0.415071D+01 -0.846807D+00  0.340551D+01 -0.152073D+02 -0.345850D+00
      3   0.101228D+00 -0.505644D+00 -0.812138D+00  0.149229D+01  0.813209D+00
      4   0.599110D+01  0.104831D+01  0.261202D+01  0.641157D+01  0.341528D+01
      5  -0.304095D+01  0.374761D+01 -0.232123D+01  0.227886D+02  0.496006D+01
      6   0.213167D+01 -0.372656D-01  0.369727D+01  0.384591D+01  0.476790D+01
                81            82            83            84            85 
      1   0.769137D+01 -0.599896D+00 -0.269899D+01 -0.329293D+00 -0.397611D+01
      2  -0.164693D+02  0.690079D+01  0.876056D+01  0.894642D+00  0.101940D+02
      3   0.877796D+01 -0.630089D+01 -0.606156D+01 -0.565349D+00 -0.621787D+01
      4   0.796631D+01  0.688663D+01  0.138435D+02  0.747271D+00  0.112288D+02
      5   0.263519D+02  0.155435D+01  0.227768D+01  0.181739D+01  0.191661D+01
      6   0.518600D+01  0.849775D+00  0.243815D+01  0.627022D+00  0.328917D+01
                86            87            88            89            90 
      1  -0.397799D+02 -0.346519D+01  0.372245D+00  0.265162D+01 -0.551040D+01
      2   0.734987D+02  0.323724D+01 -0.889635D+00 -0.769544D+01  0.471896D+01
      3  -0.337188D+02  0.227950D+00  0.517390D+00  0.504382D+01  0.791446D+00
      4   0.224755D+02  0.198509D+01 -0.151583D+01 -0.235697D+01  0.143375D+01
      5   0.299681D+01  0.183445D+01  0.958261D+00  0.191303D+01 -0.125893D+00
      6   0.140947D+02  0.875306D+01  0.360715D+00  0.829294D+01  0.158559D+01
                91            92            93            94            95 
      1  -0.107165D+01  0.101200D+01  0.354324D+01 -0.167563D+01 -0.572989D+01
      2  -0.359701D+01 -0.247095D+00  0.756075D-02  0.826671D+00  0.528389D+01
      3   0.466867D+01 -0.764903D+00 -0.355080D+01  0.848960D+00  0.446004D+00
      4  -0.186154D+01  0.298300D+01  0.306561D+01  0.551914D+00 -0.244884D-01
      5  -0.200583D+01  0.878940D+00  0.623483D+01 -0.312181D+00 -0.110716D+00
      6   0.234176D+01 -0.240270D+01 -0.480031D+01 -0.995483D+00  0.361892D+01
                96            97            98            99           100 
      1  -0.161725D+01  0.433586D+01 -0.818644D+01 -0.254601D+02  0.626707D+02
      2   0.361369D+01  0.106801D+01  0.295917D+01 -0.130481D+02 -0.288780D+02
      3  -0.199644D+01 -0.540388D+01  0.522727D+01  0.385081D+02 -0.337927D+02
      4  -0.118570D+00  0.345572D+01  0.328327D+00 -0.124776D+00 -0.327674D+02
      5  -0.473831D+00  0.501926D+01  0.675622D+00  0.214933D+01  0.181415D+02
      6   0.504207D+01 -0.262224D+01  0.121448D+02  0.292661D+02 -0.105783D+02
               101           102           103           104           105 
      1  -0.112617D+02  0.155247D+02 -0.535643D+00  0.501142D+01  0.892418D+00
      2   0.158654D+01 -0.776323D+01 -0.404036D+01  0.227937D+01 -0.247592D+00
      3   0.967511D+01 -0.776147D+01  0.457600D+01 -0.729079D+01 -0.644825D+00
      4   0.177783D+02 -0.100516D+02  0.130945D+02 -0.101133D+02 -0.233357D+00
      5  -0.592068D+01  0.111269D+02  0.302461D+01 -0.114604D+01 -0.254039D+00
      6   0.405149D+01 -0.572627D+01 -0.441315D+00  0.151548D+01  0.162370D+01
               106           107           108           109           110 
      1   0.310793D+02 -0.798050D+01  0.849327D+01  0.302513D+01 -0.101001D+02
      2  -0.171948D+02  0.427843D+01 -0.671831D+01  0.246452D+01  0.700726D+01
      3  -0.138845D+02  0.370208D+01 -0.177497D+01 -0.548964D+01  0.309284D+01
      4  -0.143329D+02  0.297230D+01 -0.348204D+01 -0.559357D+01  0.489295D+01
      5   0.982915D+01 -0.127432D+00  0.964124D+01  0.155305D+01 -0.251381D+01
      6  -0.394322D+01  0.126257D+01 -0.373508D+01  0.180997D+00  0.610431D+01
               111           112           113           114           115 
      1  -0.258975D+01 -0.323207D+01 -0.254694D+02 -0.103140D+02  0.148582D+01
      2   0.264268D+01 -0.218957D+01  0.427181D+02  0.130110D+02 -0.272413D+01
      3  -0.529317D-01  0.542164D+01 -0.172487D+02 -0.269696D+01  0.123831D+01
      4  -0.230694D+01  0.127450D+02 -0.314238D+02 -0.114856D+02  0.121326D+00
      5  -0.828324D+00  0.360870D+01 -0.137663D+02 -0.824171D+01  0.535087D-01
      6   0.335099D+01 -0.381067D+01  0.221929D+02  0.129749D+02  0.599547D+00
               116           117           118           119           120 
      1  -0.161610D+02 -0.940797D+01 -0.334978D+00 -0.126614D+01 -0.145714D+01
      2   0.205317D+02  0.721932D+01  0.254326D+00  0.384784D+00  0.173578D+00
      3  -0.437062D+01  0.218865D+01  0.806519D-01  0.881352D+00  0.128356D+01
      4  -0.120815D+02 -0.413734D+01  0.255971D+01  0.709288D+01  0.339002D+01
      5  -0.568611D+01 -0.477540D+01  0.908350D+00  0.440579D+01  0.535719D+01
      6   0.118321D+02  0.968051D+01  0.479965D+01  0.186613D+01  0.281219D+01
               121           122           123           124           125 
      1  -0.286263D+01 -0.178611D+02 -0.128634D+02 -0.620088D+00 -0.102617D+02
      2   0.160974D+01  0.145587D+02  0.542836D+01  0.533738D+00  0.242095D+01
      3   0.125289D+01  0.330243D+01  0.743501D+01  0.863499D-01  0.784076D+01
      4   0.623287D+01  0.500926D+01  0.276278D+01  0.848428D+00  0.212617D+01
      5   0.349348D+01  0.137700D+01  0.177992D+01  0.323387D+01  0.142199D+01
      6   0.205492D+01  0.222653D+02  0.188129D+02  0.248240D+01  0.162189D+02
               126           127           128           129           130 
      1  -0.147420D+02  0.117397D+02  0.391707D+01  0.681347D+01  0.607498D+01
      2  -0.109442D+01  0.109423D+02 -0.649145D+01 -0.128936D+02 -0.130002D+02
      3   0.158364D+02 -0.226820D+02  0.257438D+01  0.608014D+01  0.692520D+01
      4   0.324319D+01  0.744669D+01  0.647466D+00  0.381511D+01 -0.132056D+01
      5   0.122653D+01  0.592337D+01 -0.493740D+01 -0.206016D+02 -0.651160D+01
      6   0.162002D+02 -0.178180D+00  0.361353D+01  0.202973D+01  0.565828D+01
               131           132           133           134           135 
      1   0.929107D+01  0.265224D+01  0.655048D+01  0.550930D+01 -0.126139D+02
      2  -0.238961D+02  0.137112D+02 -0.118094D+02  0.540658D+01  0.125822D+02
      3   0.146050D+02 -0.163634D+02  0.525895D+01 -0.109159D+02  0.317203D-01
      4  -0.183918D+02  0.201560D+01  0.557398D+01  0.784490D-01  0.168928D+01
      5   0.446942D+01  0.100470D+02 -0.208284D+02  0.585300D+01  0.107848D+02
      6   0.213043D+02  0.872412D+00  0.995153D+00  0.485723D+01 -0.123856D+02
               136           137           138           139           140 
      1  -0.280187D+00  0.161650D+02  0.243219D+02  0.226732D+02  0.216452D+00
      2   0.275293D+01 -0.122616D+02 -0.120305D+02 -0.205199D+02 -0.144542D+02
      3  -0.247274D+01 -0.390340D+01 -0.122914D+02 -0.215335D+01  0.142378D+02
      4   0.149170D+02 -0.542785D+01  0.250817D+01 -0.121269D+02 -0.357498D+02
      5   0.258680D+02 -0.102993D+01 -0.137504D+02 -0.281990D+01 -0.412703D+01
      6   0.404581D+01 -0.664527D+00 -0.130626D+01 -0.185717D+01 -0.570188D+01
               141           142           143           144           145 
      1  -0.120300D+01  0.310286D+02 -0.180883D+01 -0.188961D+02  0.150500D+02
      2  -0.187936D+01 -0.151533D+02 -0.237484D+01  0.166847D+02  0.395712D+01
      3   0.308236D+01 -0.158753D+02  0.418367D+01  0.221138D+01 -0.190072D+02
      4  -0.353240D+01  0.389454D+01 -0.337685D+01  0.117810D+02 -0.305462D+02
      5   0.150463D+02 -0.205395D+02  0.136955D+02 -0.154802D+02 -0.394706D+01
      6   0.189107D+01 -0.195424D+01  0.268108D+01 -0.154868D+01  0.183753D+01
               146           147           148           149           150 
      1  -0.480639D+01 -0.187620D+01 -0.109671D+01 -0.432322D+01 -0.635323D+00
      2  -0.115075D+02  0.669033D-01 -0.120312D+02  0.224532D+02  0.299427D+01
      3   0.163139D+02  0.180930D+01  0.131279D+02 -0.181300D+02 -0.235895D+01
      4   0.278596D+02  0.375628D+01  0.236278D+02 -0.268147D+02 -0.347145D+01
      5   0.229113D+01  0.545165D+01  0.187460D+01 -0.269254D+01 -0.244172D+01
      6  -0.163841D+01 -0.303861D+01 -0.141941D+01  0.253064D+01  0.623213D+01
               151           152           153           154           155 
      1  -0.150197D+01 -0.648669D+00 -0.110541D+01  0.337556D+01  0.233200D+01
      2  -0.411685D-01  0.351858D+01  0.240418D+01 -0.126955D+02  0.118879D-01
      3   0.154314D+01 -0.286991D+01 -0.129876D+01  0.931990D+01 -0.234389D+01
      4   0.376954D+01 -0.386580D+01 -0.536908D+01 -0.468442D+01  0.436818D+01
      5   0.559541D+01 -0.432727D+01 -0.217352D+01  0.201264D+02 -0.499869D+01
      6  -0.398804D+01  0.783047D+01  0.107293D+01 -0.897893D+01  0.498497D+01
               156           157           158           159           160 
      1  -0.402417D+01 -0.116251D+01 -0.511852D+00  0.824943D+00 -0.288862D+01
      2  -0.124608D+02 -0.840310D+00 -0.113990D+01 -0.164509D+01 -0.109627D+02
      3   0.164850D+02  0.200282D+01  0.165175D+01  0.820148D+00  0.138514D+02
      4  -0.547770D+01  0.487406D+01 -0.139504D+01  0.258591D+01 -0.402638D+01
      5   0.191779D+02 -0.129419D+01  0.336772D+01 -0.713165D+00  0.169394D+02
      6  -0.962739D+01  0.289838D+01 -0.216392D+01  0.684104D+01 -0.670793D+01
               161           162           163           164           165 
      1   0.367685D+01 -0.111667D+02 -0.329539D+01 -0.769704D+01  0.856899D+01
      2   0.885890D+00 -0.164661D+02 -0.128821D+01  0.436390D+01  0.118765D+01
      3  -0.456274D+01  0.276328D+02  0.458360D+01  0.333314D+01 -0.975664D+01
      4   0.212541D+01 -0.377460D+01  0.837871D+01  0.815486D+01 -0.675763D+01
      5  -0.295923D+01  0.201905D+02 -0.114448D+02 -0.765013D+01  0.124830D+02
      6   0.749935D+01 -0.126378D+02 -0.980494D+01 -0.134854D+02  0.125700D+02
               166           167           168           169           170 
      1  -0.497452D+01 -0.102377D+02  0.917913D+01  0.386072D+01  0.754158D+01
      2   0.283201D+01  0.958733D+01 -0.163274D+01  0.663273D+00 -0.205749D+00
      3   0.214251D+01  0.650336D+00 -0.754639D+01 -0.452399D+01 -0.733583D+01
      4   0.740432D+01  0.603987D+01 -0.473257D+01 -0.443708D+01 -0.405901D+01
      5  -0.550678D+01 -0.683211D+01  0.522947D+01  0.871093D+01  0.474564D+01
      6  -0.865326D+01 -0.140109D+02  0.146933D+02  0.619809D+01  0.120483D+02
               171           172           173           174           175 
      1  -0.108799D+02 -0.468589D+01  0.842211D+00 -0.102857D+02 -0.103804D+01
      2  -0.329476D+01 -0.424539D+01 -0.640609D+00 -0.368971D+01  0.140989D+01
      3   0.141747D+02  0.893128D+01 -0.201602D+00  0.139754D+02 -0.371843D+00
      4   0.457381D+01 -0.919998D+01  0.406213D+00 -0.195901D+01  0.130748D+01
      5  -0.770613D+01  0.131527D+02  0.166844D+01  0.793287D+01  0.199055D+01
      6  -0.147053D+02  0.111080D+00  0.426478D+01 -0.544025D+01  0.226571D+01
               176           177           178           179           180 
      1  -0.296688D+01 -0.493156D+00 -0.629261D+01 -0.117609D+00 -0.632337D+01
      2   0.336076D+01 -0.280188D+01 -0.256274D+01 -0.113175D+01 -0.619432D+01
      3  -0.393879D+00  0.329503D+01  0.885535D+01  0.124936D+01  0.125177D+02
      4   0.110336D+01  0.161742D+00 -0.210381D+01  0.340712D+00 -0.320859D+01
      5   0.170707D+01 -0.181172D+01  0.946273D+01 -0.852378D-01  0.479041D+01
      6  -0.151045D+01  0.238509D+01 -0.232563D+01  0.246469D+01 -0.176716D+01
               181           182           183           184           185 
      1  -0.403795D+00  0.154242D+01 -0.570274D+00 -0.811397D+00 -0.206890D+02
      2   0.153164D+01  0.160020D+01  0.159607D+01  0.547091D+01  0.376517D+02
      3  -0.112784D+01 -0.314262D+01 -0.102579D+01 -0.465951D+01 -0.169628D+02
      4   0.430595D+01  0.812856D+01 -0.236551D+01  0.104220D+02  0.212780D+02
      5  -0.264196D+01 -0.329098D+01  0.510055D+01 -0.429566D+01 -0.590914D+01
      6  -0.309486D+01 -0.316922D+01  0.112719D+01 -0.600767D+01 -0.300209D+02
               186           187           188           189           190 
      1   0.804029D+01  0.387712D+00  0.203442D+01 -0.231397D+01  0.847123D+01
      2  -0.556711D+01  0.182212D+01  0.144310D+01  0.125654D+01 -0.170067D+02
      3  -0.247318D+01 -0.220983D+01 -0.347752D+01  0.105742D+01  0.853552D+01
      4  -0.526073D+01  0.991884D-01  0.558473D+00  0.215981D+01  0.249650D+01
      5   0.406889D+01  0.317710D+01  0.143224D+01 -0.196998D+01 -0.229897D+02
      6   0.136694D+02  0.118429D+01  0.650791D+01 -0.302302D+01 -0.295746D+00
               191           192           193           194           195 
      1  -0.214854D+01 -0.128323D+01 -0.327592D+01 -0.756243D+00 -0.165192D+01
      2   0.373410D+01  0.164491D+02  0.685100D+01 -0.934672D+00 -0.865512D+01
      3  -0.158556D+01 -0.151659D+02 -0.357508D+01  0.169091D+01  0.103070D+02
      4   0.366140D+01 -0.324509D+01  0.288708D+01 -0.659258D+00 -0.301110D+01
      5   0.276562D+01  0.245961D+02  0.842239D+01 -0.574859D+01 -0.960862D+01
      6  -0.517588D+01  0.193758D+01 -0.443210D+01  0.187205D+01  0.511212D+01
               196           197           198           199           200 
      1  -0.120910D+01 -0.436359D+00 -0.632823D+01  0.893877D+01 -0.434490D+01
      2   0.136429D+02 -0.368737D+01 -0.221294D+02 -0.800307D+01  0.325256D+01
      3  -0.124338D+02  0.412373D+01  0.284577D+02 -0.935692D+00  0.109234D+01
      4  -0.216187D+01 -0.265416D+01  0.164909D+01 -0.328169D+01  0.259915D+01
      5   0.201916D+02 -0.322055D+01 -0.261157D+02  0.876166D+01 -0.295388D+01
      6   0.547941D+00  0.525948D+01 -0.699745D+00 -0.442781D+00  0.499227D+00
               201           202           203           204           205 
      1   0.620200D+01 -0.999117D+01  0.987851D+00 -0.191267D+01  0.125951D+02
      2  -0.633303D+01  0.674066D+01 -0.302218D+00  0.364870D+01 -0.109231D+02
      3   0.131030D+00  0.325051D+01 -0.685633D+00 -0.173603D+01 -0.167204D+01
      4  -0.157509D+01  0.446050D+01 -0.194084D+01  0.623114D+01  0.281956D+00
      5   0.138035D+02 -0.499993D+01  0.604443D+01 -0.100785D+02  0.206728D+02
      6   0.525152D+00  0.889642D+00 -0.135877D+01  0.244107D+01  0.238819D+01
               206           207           208           209           210 
      1  -0.312638D+00  0.685973D+01  0.531723D+02 -0.903007D+01 -0.180013D+02
      2   0.345517D+01 -0.170833D+02 -0.290564D+02  0.565976D+01  0.102541D+02
      3  -0.314253D+01  0.102236D+02 -0.241159D+02  0.337031D+01  0.774716D+01
      4   0.783122D+01 -0.527886D+01 -0.263800D+01  0.810116D+01  0.113661D+01
      5  -0.722957D+01  0.334238D+02 -0.193834D+02  0.301769D+01  0.151356D+02
      6   0.287965D+01  0.325156D+01 -0.190760D+01 -0.377460D-01  0.165604D+01
               211           212           213           214           215 
      1  -0.190267D+02  0.716905D+01  0.466188D+01 -0.329343D+02  0.375476D+01
      2   0.112966D+02 -0.192837D+01 -0.265065D+01  0.191670D+02 -0.245587D+01
      3   0.773005D+01 -0.524068D+01 -0.201123D+01  0.137673D+02 -0.129889D+01
      4   0.107391D+02 -0.243336D+01 -0.409798D+01 -0.861425D+00 -0.647971D+01
      5   0.592965D+01 -0.396709D+01 -0.719483D+01  0.213214D+02 -0.488056D+01
      6  -0.695882D+00  0.140174D+01  0.125424D+01  0.161966D+01  0.115544D+01
               216           217           218           219           220 
      1   0.144422D+02  0.649063D+01  0.572951D+01 -0.124016D+01  0.972229D+01
      2  -0.119147D+02 -0.597383D-02 -0.552002D+00  0.995374D+00  0.428606D+01
      3  -0.252752D+01 -0.648466D+01 -0.517751D+01  0.244787D+00 -0.140083D+02
      4  -0.283935D+01  0.829676D+01  0.118180D+02  0.113502D+01  0.263440D+02
      5  -0.165619D+02 -0.774797D+00  0.176612D+01  0.305666D+01  0.403480D+01
      6  -0.130416D+01  0.849007D+00  0.868049D+00  0.242007D+00  0.327412D+01
               221           222           223           224           225 
      1  -0.450574D+01  0.283708D+00 -0.313426D+01 -0.257115D+00  0.112419D+01
      2   0.263128D+02  0.822800D+00  0.140230D+01  0.804311D+00  0.268451D+00
      3  -0.218071D+02 -0.110651D+01  0.173195D+01 -0.547195D+00 -0.139264D+01
      4   0.483009D+02  0.436616D+01  0.113839D+01  0.286794D+01  0.442978D+01
      5   0.455825D+01  0.637628D+01  0.632725D+01  0.437037D+01  0.296935D+01
      6   0.763668D+01  0.662847D+01  0.279120D+01  0.620154D+01  0.151991D+01
               226           227           228           229           230 
      1   0.162373D+02  0.115182D+02 -0.511311D+01  0.754330D+01  0.272338D+01
      2  -0.591585D+01 -0.295028D+01  0.127790D+01  0.219731D+00  0.615757D+01
      3  -0.103215D+02 -0.856787D+01  0.383521D+01 -0.776303D+01 -0.888095D+01
      4   0.194171D+02  0.224088D+02 -0.644115D+01  0.153112D+02  0.270899D+02
      5  -0.660262D+01 -0.327101D+01  0.766038D+01 -0.336321D+01 -0.667103D+01
      6  -0.493201D+01 -0.486461D+01  0.396982D+01 -0.468838D+01 -0.611879D+01
               231           232           233           234 
      1  -0.303662D+01 -0.976693D+01 -0.410612D+01  0.566305D+01
      2  -0.148351D+01  0.375584D+01 -0.200974D+01 -0.348611D+01
      3   0.452013D+01  0.601109D+01  0.611586D+01 -0.217695D+01
      4  -0.817329D+01 -0.118415D+02 -0.208932D+02  0.105812D+02
      5   0.317369D+01  0.100461D+02  0.756240D+01 -0.953557D+01
      6   0.628242D+01  0.581663D+01  0.833288D+01 -0.626384D+01
 Leave Link  716 at Fri Jul 16 13:48:27 2021, MaxMem=  5637144576 cpu:               2.6 elap:               0.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l9999.exe)
 AllDun F.D. properties on file 20721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.093368
 Property number 1 -- Alpha(-w,w) frequency  1    0.093368:
                 1             2             3 
      1   0.128833D+03 -0.786079D+01  0.386789D+00
      2  -0.786079D+01  0.120183D+03  0.111981D+01
      3   0.386789D+00  0.111981D+01  0.104445D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.093368:
                 1             2             3 
      1   0.420415D+01 -0.350793D+01  0.233606D+01
      2   0.825784D+01  0.236902D+01 -0.775970D+01
      3   0.108536D+02 -0.971532D+01 -0.680944D+01
 Property number 4 -- D-Q polarizability frequency  1    0.093368:
                 1             2             3 
      1   0.123295D+02 -0.316644D+02  0.465418D+01
      2   0.206915D+02 -0.800891D+01 -0.927699D+01
      3  -0.330210D+02  0.396733D+02  0.462280D+01
      4  -0.751977D+02  0.593936D+02  0.132454D+02
      5   0.664644D+01  0.193590D+02 -0.226951D+02
      6   0.984737D+01 -0.469554D+01  0.264521D+00
 AllDun F.D. properties on file 20722 Mask=       B NFrqRd=     1 NDeriv=    78 ND12= 1 LenFil=    2811:
 Frequencies=    0.093368
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1  -0.185877D+01 -0.212944D+01 -0.177401D+01 -0.985537D+00  0.113103D+01
      2  -0.212944D+01 -0.165956D+01  0.110733D+01  0.113103D+01 -0.400076D+01
      3  -0.177401D+01  0.110733D+01 -0.278540D+01  0.187203D+01  0.119075D+01
                 6             7             8             9            10 
      1   0.187203D+01 -0.337941D+01  0.200165D+01 -0.355209D+01 -0.545410D-01
      2   0.119075D+01  0.200165D+01  0.273123D+01 -0.106461D+01  0.224620D+01
      3  -0.545453D-01 -0.355209D+01 -0.106461D+01 -0.739650D+00  0.160603D+01
                11            12            13            14            15 
      1   0.224620D+01  0.160603D+01  0.185599D+01 -0.324935D+01 -0.162961D+00
      2  -0.334790D+01 -0.854288D-01 -0.324935D+01 -0.676123D+01  0.612896D+00
      3  -0.854288D-01  0.195767D+01 -0.162961D+00  0.612896D+00  0.913191D+00
                16            17            18            19            20 
      1   0.221360D+01  0.129509D+00  0.189268D+01 -0.131139D+02  0.938422D+01
      2   0.129509D+00  0.139543D+01 -0.231938D+00  0.938422D+01 -0.768116D+01
      3   0.189268D+01 -0.231938D+00 -0.578269D+01  0.308179D+01 -0.550428D+00
                21            22            23            24            25 
      1   0.308179D+01  0.890279D+01 -0.776102D+01 -0.131473D+01  0.340253D+00
      2  -0.550428D+00 -0.776102D+01  0.105068D+02 -0.213559D+01  0.418203D+00
      3  -0.137152D+01 -0.131473D+01 -0.213559D+01  0.216433D+01 -0.103966D+01
                26            27            28            29            30 
      1   0.418203D+00 -0.103966D+01  0.688836D+01 -0.656430D+01 -0.553643D+01
      2  -0.184039D+01  0.116142D+01 -0.656430D+01  0.743264D+01  0.253387D+01
      3   0.116142D+01  0.639914D-01 -0.553643D+01  0.253387D+01  0.218621D+01
                31            32            33            34            35 
      1  -0.951446D+01  0.840063D+01  0.473016D+00 -0.667077D+01  0.137936D+01
      2   0.840063D+01 -0.859623D+01  0.394680D+01  0.137936D+01  0.519331D+01
      3   0.473016D+00  0.394680D+01 -0.213427D+01  0.351979D+01 -0.330672D+01
                36            37            38            39            40 
      1   0.351979D+01  0.123834D+02 -0.581534D+01 -0.393982D+01 -0.220965D+01
      2  -0.330672D+01 -0.581534D+01  0.347659D+01 -0.579202D+00  0.267086D+01
      3  -0.794435D+00 -0.393982D+01 -0.579202D+00  0.252451D+01 -0.109769D+01
                41            42            43            44            45 
      1   0.267086D+01 -0.109769D+01 -0.744358D+01  0.361616D+00  0.313497D+01
      2   0.104148D+01  0.554547D+01  0.361616D+00  0.504875D+01  0.106478D+01
      3   0.554547D+01  0.859492D+00  0.313497D+01  0.106478D+01 -0.118817D+01
                46            47            48            49            50 
      1  -0.492559D+01  0.327311D+01  0.599810D+01  0.447410D+01 -0.489935D+01
      2   0.327311D+01 -0.276478D+01  0.937575D-01 -0.489935D+01 -0.728926D+01
      3   0.599810D+01  0.937575D-01 -0.232979D+01 -0.160773D+00 -0.452110D+00
                51            52            53            54            55 
      1  -0.160773D+00  0.117607D+02 -0.198492D+01 -0.274511D+01  0.192768D+01
      2  -0.452110D+00 -0.198492D+01  0.940795D+00  0.241767D+01 -0.327146D+01
      3   0.177020D+01 -0.274511D+01  0.241767D+01 -0.925444D+00 -0.245102D+01
                56            57            58            59            60 
      1  -0.327146D+01 -0.245102D+01 -0.328709D+01  0.611320D+01  0.955924D-01
      2   0.566724D+01 -0.110826D+00  0.611320D+01  0.385642D+01 -0.233534D+01
      3  -0.110826D+00 -0.132677D+01  0.955924D-01 -0.233534D+01  0.168691D+01
                61            62            63            64            65 
      1  -0.242905D+01 -0.661421D+00 -0.145620D+01  0.595667D-01 -0.876975D+00
      2  -0.661421D+00 -0.309620D+01  0.393598D+00 -0.876975D+00 -0.378861D+01
      3  -0.145620D+01  0.393598D+00  0.477363D+01  0.409282D+01  0.255271D+01
                66            67            68            69            70 
      1   0.409282D+01  0.798709D+00 -0.415128D+01  0.319763D+01  0.368180D+01
      2   0.255271D+01 -0.415128D+01  0.389176D+01 -0.130329D+01  0.174260D+01
      3   0.184668D+01  0.319763D+01 -0.130329D+01 -0.273857D+01  0.146484D+01
                71            72            73            74            75 
      1   0.174260D+01  0.146484D+01  0.449018D+01  0.590828D+00  0.264515D+01
      2  -0.273117D+00 -0.222688D+01  0.590828D+00  0.127994D+01  0.449470D+00
      3  -0.222688D+01 -0.120779D+01  0.264515D+01  0.449470D+00  0.243932D+01
                76            77            78            79            80 
      1  -0.677418D+00  0.723380D+00 -0.540641D+00  0.382802D+01  0.199191D+00
      2   0.723380D+00 -0.263528D-02  0.553316D+00  0.199191D+00  0.604864D+00
      3  -0.540641D+00  0.553316D+00 -0.279411D+00  0.327084D+01  0.809858D+00
                81            82            83            84            85 
      1   0.327084D+01  0.909542D+00  0.147742D+01 -0.956413D-01  0.154310D+01
      2   0.809858D+00  0.147742D+01  0.184737D+01  0.209917D+00  0.211584D+01
      3   0.429266D+01 -0.956413D-01  0.209917D+00 -0.103581D+00  0.252612D+00
                86            87            88            89            90 
      1   0.211584D+01  0.252612D+00 -0.655907D+00 -0.218016D+00 -0.167494D-01
      2   0.119636D+02  0.802749D+00 -0.218016D+00 -0.129288D+01  0.119129D+01
      3   0.802749D+00  0.100026D+01 -0.167494D-01  0.119129D+01  0.478979D+00
                91            92            93            94            95 
      1  -0.812002D+00 -0.125669D+00  0.970034D+00 -0.404942D+00 -0.201171D-02
      2  -0.125669D+00  0.403443D-01 -0.278667D+00 -0.201171D-02  0.680051D+00
      3   0.970034D+00 -0.278667D+00 -0.125714D+01  0.303695D-01  0.969314D+00
                96            97            98            99           100 
      1   0.303695D-01  0.130829D+01 -0.157289D-01 -0.907473D+00  0.952112D+01
      2   0.969314D+00 -0.157289D-01  0.161316D+01  0.181197D+01 -0.252443D+01
      3  -0.145418D+00 -0.907473D+00  0.181197D+01  0.863427D+01  0.295889D+01
               101           102           103           104           105 
      1  -0.252443D+01  0.295889D+01 -0.684017D+00  0.156074D+01  0.441416D+00
      2   0.185777D+01 -0.849805D+00  0.156074D+01 -0.160725D+01 -0.243686D+00
      3  -0.849805D+00  0.148332D+01  0.441416D+00 -0.243686D+00  0.180174D-01
               106           107           108           109           110 
      1   0.527618D+01 -0.891679D+00  0.145444D+01  0.105668D+01 -0.123190D+01
      2  -0.891679D+00 -0.545657D-01 -0.145287D-01 -0.123190D+01 -0.837474D+00
      3   0.145444D+01 -0.145287D-01  0.117102D+01  0.170368D+00 -0.107720D+01
               111           112           113           114           115 
      1   0.170368D+00 -0.155984D+01  0.148406D+01  0.445216D+00  0.595834D-01
      2  -0.107720D+01  0.148406D+01 -0.842413D+01 -0.310284D+01 -0.543874D-01
      3  -0.561839D+00  0.445216D+00 -0.310284D+01 -0.182527D+01 -0.243922D+00
               116           117           118           119           120 
      1  -0.543874D-01 -0.243922D+00 -0.600131D+00 -0.954438D+00 -0.463691D+00
      2  -0.415913D+01 -0.161982D+01 -0.954438D+00 -0.814168D+00 -0.391914D+00
      3  -0.161982D+01 -0.142550D+01 -0.463691D+00 -0.391914D+00 -0.706052D+00
               121           122           123           124           125 
      1  -0.165465D+01 -0.511971D+00 -0.470804D+00  0.620077D-01 -0.463799D+00
      2  -0.511971D+00 -0.536667D+01 -0.337021D+01 -0.463799D+00 -0.264940D+01
      3  -0.470804D+00 -0.337021D+01 -0.289806D+01 -0.564879D+00 -0.270657D+01
               126           127           128           129           130 
      1  -0.564879D+00 -0.249889D+01 -0.159618D+01 -0.468384D+01 -0.189993D+01
      2  -0.270657D+01 -0.159618D+01  0.124813D+01  0.176728D+00  0.211275D+01
      3  -0.364974D+01 -0.468384D+01  0.176728D+00  0.217071D+01  0.600124D+00
               131           132           133           134           135 
      1   0.211275D+01  0.600124D+00 -0.473520D+01  0.465149D+00  0.222616D+01
      2   0.680233D+01 -0.844429D+00  0.465149D+00  0.980749D-01 -0.253427D+01
      3  -0.844429D+00 -0.287196D+01  0.222616D+01 -0.253427D+01 -0.201425D+00
               136           137           138           139           140 
      1   0.411254D+00 -0.238047D+01 -0.428065D+01 -0.361912D+01  0.339814D+01
      2  -0.238047D+01  0.132305D+01  0.569088D-01  0.339814D+01  0.674796D+01
      3  -0.428065D+01  0.569088D-01  0.211407D+01  0.278184D+00  0.953490D+00
               141           142           143           144           145 
      1   0.278184D+00 -0.614169D+01  0.916683D+00  0.325932D+01 -0.613472D+01
      2   0.953490D+00  0.916683D+00  0.416219D+00 -0.256368D+01  0.425004D+01
      3  -0.285063D+01  0.325932D+01 -0.256368D+01  0.291050D+01  0.969719D+00
               146           147           148           149           150 
      1   0.425004D+01  0.969719D+00  0.328389D+01 -0.382231D+01 -0.210811D+00
      2  -0.453002D+01 -0.532496D+00 -0.382231D+01  0.531102D+01  0.925948D+00
      3  -0.532496D+00 -0.776640D+00 -0.210811D+00  0.925948D+00  0.740112D+00
               151           152           153           154           155 
      1   0.104633D+01 -0.363466D+00 -0.925433D+00 -0.461393D+01  0.864240D+00
      2  -0.363466D+00  0.112539D+01  0.125676D+01  0.864240D+00 -0.102948D+01
      3  -0.925433D+00  0.125676D+01  0.366746D+00 -0.329286D+01  0.668204D+00
               156           157           158           159           160 
      1  -0.329286D+01 -0.186563D+00 -0.488112D+00  0.371153D-01 -0.289293D+01
      2   0.668204D+00 -0.488112D+00  0.976046D-01 -0.741389D+00  0.558397D+00
      3  -0.396157D+01  0.371153D-01 -0.741389D+00  0.421545D+00 -0.328419D+01
               161           162           163           164           165 
      1   0.558397D+00 -0.328419D+01  0.300388D+01  0.194751D+01 -0.245783D+01
      2  -0.100305D+01  0.117030D+01  0.194751D+01  0.271526D+01 -0.210158D+01
      3   0.117030D+01 -0.549905D+01 -0.245783D+01 -0.210158D+01  0.294103D+01
               166           167           168           169           170 
      1   0.113022D+01  0.194560D+01 -0.125845D+01 -0.123301D+01 -0.107999D+01
      2   0.194560D+01  0.289318D+01 -0.210077D+01 -0.107999D+01 -0.148512D+01
      3  -0.125845D+01 -0.210077D+01  0.247659D+01  0.132403D+01  0.218811D+01
               171           172           173           174           175 
      1   0.132403D+01  0.526496D+01  0.614784D+00  0.172159D+01  0.778048D+00
      2   0.218811D+01  0.614784D+00  0.937624D+00 -0.269309D+00  0.510712D+00
      3  -0.343195D+01  0.172159D+01 -0.269309D+00  0.271006D+01 -0.654457D-01
               176           177           178           179           180 
      1   0.510712D+00 -0.654457D-01  0.152498D+01  0.620133D-01  0.152122D+01
      2  -0.265261D+00  0.417201D+00  0.620133D-01  0.345647D+00  0.183814D+00
      3   0.417201D+00  0.562098D+00  0.152122D+01  0.183814D+00  0.208428D+01
               181           182           183           184           185 
      1  -0.406952D+00 -0.978518D+00  0.718585D+00 -0.136669D+01 -0.178730D+01
      2  -0.978518D+00 -0.940707D+00  0.162478D+00 -0.178730D+01 -0.872345D+01
      3   0.718585D+00  0.162478D+00 -0.579314D+00  0.421617D+00  0.220196D+01
               186           187           188           189           190 
      1   0.421617D+00  0.218293D+00 -0.104196D+00 -0.395845D+00 -0.377891D+01
      2   0.220196D+01 -0.104196D+00  0.226607D-01 -0.772214D+00  0.531054D+00
      3  -0.178915D+01 -0.395845D+00 -0.772214D+00  0.355375D+00  0.349797D+01
               191           192           193           194           195 
      1   0.531054D+00  0.349797D+01  0.150505D+01 -0.957763D+00 -0.117137D+01
      2  -0.107884D+01 -0.188999D+00 -0.957763D+00  0.232607D+00  0.103680D+01
      3  -0.188999D+00 -0.412481D+01 -0.117137D+01  0.103680D+01  0.229573D+01
               196           197           198           199           200 
      1   0.257008D+01 -0.258639D+00 -0.317320D+01 -0.136527D+01  0.814925D+00
      2  -0.258639D+00  0.680284D+00  0.775325D+00  0.814925D+00 -0.331049D+00
      3  -0.317320D+01  0.775325D+00  0.563610D+01 -0.125642D+01  0.302151D+00
               201           202           203           204           205 
      1  -0.125642D+01  0.176242D+01 -0.697757D+00  0.560677D+00 -0.257857D+01
      2   0.302151D+00 -0.697757D+00  0.367237D+00 -0.117886D+01  0.491274D-01
      3  -0.162879D+01  0.560677D+00 -0.117886D+01  0.171921D+01 -0.271542D+01
               206           207           208           209           210 
      1   0.491274D-01 -0.271542D+01 -0.743410D+01  0.107783D+01  0.271891D+01
      2  -0.131639D+01  0.135283D+01  0.107783D+01 -0.919017D+00 -0.462006D+00
      3   0.135283D+01 -0.575238D+01  0.271891D+01 -0.462006D+00 -0.179436D+01
               211           212           213           214           215 
      1   0.319203D+01 -0.174061D+01 -0.831051D+00  0.578780D+01 -0.581920D+00
      2  -0.174061D+01  0.329549D+00  0.584869D+00 -0.581920D+00  0.920694D+00
      3  -0.831051D+00  0.584869D+00  0.108049D+01 -0.280414D+01  0.742510D+00
               216           217           218           219           220 
      1  -0.280414D+01 -0.123886D+01 -0.108635D+01  0.206039D+00 -0.318263D+01
      2   0.742510D+00 -0.108635D+01 -0.906664D+00 -0.924678D-01 -0.368115D+01
      3   0.226767D+01  0.206039D+00 -0.924678D-01 -0.199881D+00 -0.511118D+00
               221           222           223           224           225 
      1  -0.368115D+01 -0.511118D+00  0.421909D+00 -0.258083D+00 -0.904510D+00
      2  -0.828209D+01 -0.761252D+00 -0.258083D+00 -0.471176D+00 -0.799893D+00
      3  -0.761252D+00 -0.990638D+00 -0.904510D+00 -0.799893D+00 -0.494695D+00
               226           227           228           229           230 
      1   0.291995D+01  0.246329D+01 -0.112378D+01  0.200618D+01  0.158303D+01
      2   0.246329D+01  0.280349D+01 -0.743187D+00  0.158303D+01  0.459741D+01
      3  -0.112378D+01 -0.743187D+00  0.113389D+01 -0.909757D+00 -0.117180D+01
               231           232           233           234 
      1  -0.909757D+00 -0.193973D+01 -0.134725D+01  0.166054D+01
      2  -0.117180D+01 -0.134725D+01 -0.349510D+01  0.132089D+01
      3   0.869755D+00  0.166054D+01  0.132089D+01 -0.194229D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1   0.179003D+01 -0.165329D+01  0.325363D+01  0.686291D+00 -0.352446D+01
      2  -0.679563D+01  0.731028D+01 -0.484415D+01  0.627319D+01  0.490595D+01
      3   0.858036D+01 -0.818798D+01 -0.718851D+01 -0.242425D+01  0.613745D+01
                 6             7             8             9            10 
      1  -0.105411D+01  0.392532D+01  0.956136D+01  0.242985D+01 -0.178921D+01
      2  -0.412620D+00 -0.102662D+02 -0.615939D+01 -0.466833D+00  0.207587D+01
      3  -0.154511D+01 -0.100839D+02 -0.297160D+01 -0.286328D+01 -0.909032D+00
                11            12            13            14            15 
      1  -0.316384D+01 -0.415388D+01 -0.300375D+01 -0.111115D+02 -0.406457D+01
      2  -0.229215D+01  0.475381D+00 -0.314605D+01  0.233707D+01  0.564064D+00
      3   0.753942D+01  0.476963D+01  0.116685D+02 -0.525642D+01 -0.334561D+00
                16            17            18            19            20 
      1  -0.518400D+01  0.543057D+01  0.152864D+02 -0.260385D+01  0.180814D+01
      2  -0.481065D+01  0.709531D+00 -0.533399D+01  0.116782D+01  0.610308D+01
      3   0.636142D+01  0.298517D+00  0.310723D+01  0.396586D+01 -0.287708D+01
                21            22            23            24            25 
      1  -0.517772D+01 -0.644609D+00 -0.864996D+01  0.581106D+01 -0.907621D+01
      2  -0.391271D+01  0.374970D+01 -0.699709D+01  0.660971D+01 -0.145664D+02
      3  -0.377779D+01  0.118802D+02 -0.169122D+02  0.674050D+01  0.850946D+00
                26            27            28            29            30 
      1   0.143153D+02  0.184691D+01 -0.808841D+01 -0.298871D-01  0.436330D+01
      2   0.822325D+01 -0.193260D+01 -0.737502D+01  0.422538D+01  0.569205D+01
      3   0.318903D+01 -0.327122D+00  0.864555D+01 -0.130747D+02  0.323437D+01
                31            32            33            34            35 
      1  -0.393882D+01  0.107759D+02 -0.732825D+01  0.153093D+01 -0.439924D+00
      2  -0.327572D+01  0.150095D+02 -0.689153D+01 -0.133548D+01 -0.436194D+01
      3  -0.809516D+00  0.424092D+01 -0.113924D+02  0.891556D+01 -0.172233D+02
                36            37            38            39            40 
      1   0.329104D+01 -0.715880D+00 -0.175586D+01  0.260349D+01 -0.464504D+01
      2  -0.191964D+01  0.118649D+02 -0.739205D+01 -0.215496D+01 -0.358850D+01
      3   0.230926D+01 -0.258178D+01 -0.822817D-01  0.126484D+01  0.866928D+01
                41            42            43            44            45 
      1   0.767107D+01 -0.921195D+01  0.668460D+01 -0.444764D+01 -0.215886D+01
      2   0.363129D+01 -0.181533D+01 -0.163663D+02  0.420283D+01  0.412476D+01
      3  -0.474205D+01 -0.162574D+01  0.260042D+01  0.533265D+00 -0.221335D+01
                46            47            48            49            50 
      1   0.369389D+01 -0.353733D+00 -0.157788D+01 -0.176650D+01 -0.396443D+01
      2  -0.143037D+02  0.132105D+01  0.928951D+01  0.363361D+01 -0.102409D+01
      3   0.422555D+01 -0.105475D+02 -0.180809D+01 -0.121790D+01 -0.135863D+02
                51            52            53            54            55 
      1  -0.175028D+01 -0.383854D+01  0.816504D+01  0.546498D+00  0.350079D+01
      2  -0.371628D+01  0.428396D+01 -0.749364D+01  0.359795D+01  0.249820D+01
      3  -0.139553D+01 -0.546604D+01  0.107977D+01  0.736503D+01 -0.286323D+01
                56            57            58            59            60 
      1   0.148854D+01  0.520238D+01  0.223550D+01  0.430309D+01 -0.494991D+01
      2   0.239881D+01  0.409412D+01  0.140701D+01  0.208977D+01 -0.146924D+01
      3  -0.451260D+01 -0.405012D+01  0.352153D+01  0.134393D+02 -0.202906D+01
                61            62            63            64            65 
      1   0.312177D+01  0.229736D+01 -0.112672D+02 -0.171361D+01  0.352013D+01
      2  -0.149702D+01 -0.236669D+01 -0.561425D+01 -0.168854D+01 -0.536242D+01
      3  -0.531433D+01 -0.393113D+01 -0.319728D+01  0.133300D+01 -0.715125D+01
                66            67            68            69            70 
      1  -0.100474D+02  0.678210D+01 -0.852656D+01  0.410995D+01 -0.725909D+01
      2   0.115780D+02 -0.267349D+01 -0.703436D+01  0.889140D+01  0.411806D+01
      3   0.755433D+01 -0.163432D+01 -0.835743D+00  0.299003D+01  0.522315D+01
                71            72            73            74            75 
      1   0.726487D+01  0.841554D+01 -0.301037D+01  0.543051D+00 -0.295939D+01
      2   0.684651D+01  0.654109D+01  0.277056D+01  0.148094D+01  0.609118D+01
      3   0.163693D+01  0.170981D+01  0.388559D+01 -0.379720D+01  0.228224D+01
                76            77            78            79            80 
      1   0.287229D+00 -0.561931D-01 -0.122491D+00 -0.316279D+01  0.109813D+01
      2  -0.592850D+00  0.566509D+00 -0.779204D+00  0.316192D+01  0.205855D+01
      3  -0.320401D+00  0.208640D+01 -0.114471D+01  0.463290D+01 -0.232836D+01
                81            82            83            84            85 
      1  -0.446099D+01  0.168889D+01  0.188456D+01  0.913747D-01  0.124131D+01
      2   0.903740D+01 -0.995618D+00 -0.110199D+01  0.143000D+01 -0.171023D+01
      3   0.252771D+01  0.205358D+01  0.218274D+00 -0.656660D+00  0.554079D+01
                86            87            88            89            90 
      1   0.960826D+01 -0.467192D+01  0.140491D+00 -0.230313D+01  0.208705D+00
      2  -0.145518D+01  0.870020D+00 -0.663467D-01  0.464759D+00  0.161257D+00
      3  -0.273273D+01  0.428906D+00 -0.189244D+01  0.606985D+00 -0.580503D+00
                91            92            93            94            95 
      1  -0.251060D+01 -0.449025D+00  0.279535D+01 -0.671191D+00 -0.158955D+01
      2   0.140805D+01  0.504607D+00 -0.774880D+00  0.118015D+01  0.615485D+00
      3  -0.230526D+01 -0.222255D+01  0.177419D+01 -0.613209D+00  0.105999D+01
                96            97            98            99           100 
      1   0.137791D+01  0.251311D+01  0.166660D+01 -0.180044D+02  0.757699D+01
      2  -0.490264D+00 -0.533157D+01  0.711191D+00  0.565555D+01  0.106534D+02
      3  -0.542145D+00  0.367004D+01 -0.701203D+00 -0.215031D+01 -0.110120D+02
               101           102           103           104           105 
      1  -0.116021D+01  0.341906D+01  0.230604D+00  0.319505D+00 -0.151700D+00
      2  -0.476564D+01  0.822349D+01  0.115308D+01 -0.124428D+01  0.470285D+00
      3  -0.316298D+01 -0.365012D+01 -0.142102D+01  0.947904D+00  0.434120D-02
               106           107           108           109           110 
      1   0.344481D+01  0.766042D+00  0.180467D+01  0.195098D+01 -0.185937D+01
      2   0.262382D+01  0.200853D+01  0.522552D+01 -0.116922D+00 -0.277005D+01
      3  -0.866924D+01  0.119858D+01 -0.197442D+01  0.269952D+01  0.357446D+01
               111           112           113           114           115 
      1  -0.176732D+01  0.143300D+01 -0.270484D+01 -0.539550D+01 -0.199808D+01
      2  -0.811191D+00 -0.126011D+01 -0.723179D+01 -0.384806D+01 -0.921314D+00
      3   0.248832D+01  0.191902D+01  0.195269D+02  0.786409D+01  0.947078D+00
               116           117           118           119           120 
      1   0.109970D+01 -0.354302D+01  0.698773D+00  0.595817D+00 -0.134675D+00
      2  -0.495434D+01 -0.277247D+01 -0.492924D+00 -0.661963D+00  0.749162D+00
      3   0.120598D+02  0.421385D+01  0.727784D-01 -0.705293D+00 -0.718704D-01
               121           122           123           124           125 
      1  -0.335194D+00  0.573957D+01 -0.106840D+01 -0.174813D-01  0.331379D+01
      2  -0.289398D+01 -0.232144D+00  0.271644D+00 -0.247429D+01 -0.492318D+00
      3   0.486584D+01 -0.177604D-01  0.143652D+00  0.126690D+01  0.129979D+00
               126           127           128           129           130 
      1  -0.909739D+00 -0.906991D+01  0.200317D+01  0.279400D+01  0.591910D+01
      2  -0.426635D+00  0.136187D+02  0.119787D+01  0.100499D+02  0.232518D+01
      3   0.201099D+00  0.231420D+01  0.125079D+01  0.685074D+01  0.603874D+01
               131           132           133           134           135 
      1   0.147599D+02 -0.898451D+01  0.317687D+01 -0.484348D+00 -0.633756D+01
      2  -0.220081D+01  0.249857D+01  0.507193D+01  0.314390D+01 -0.399367D+01
      3   0.724386D+01 -0.120118D+01  0.669765D+01  0.827662D-01 -0.580102D+01
               136           137           138           139           140 
      1  -0.222435D+01 -0.796629D-01  0.259605D+01 -0.122852D+01 -0.151497D+01
      2   0.121341D+02 -0.190155D+01 -0.802384D+01 -0.307960D+01 -0.191648D+01
      3  -0.832153D+01  0.529663D+01  0.341265D+01  0.152983D+02  0.200729D+02
               141           142           143           144           145 
      1  -0.521486D+01  0.415219D+01 -0.908292D+00  0.418146D+01 -0.162485D+01
      2   0.938341D+01 -0.191295D+02  0.898028D+01 -0.108435D+02 -0.481757D-02
      3   0.347307D+01  0.394069D+01  0.280011D+01 -0.117544D+02 -0.732558D+01
               146           147           148           149           150 
      1   0.255245D+00  0.296837D+01  0.397827D+00 -0.143865D+01 -0.399666D+01
      2   0.554205D+00  0.324873D+01 -0.483380D+00 -0.568756D+00 -0.225334D+01
      3  -0.856979D+00  0.938365D+00  0.458010D+01  0.234030D+00  0.247142D+00
               151           152           153           154           155 
      1   0.178915D+01 -0.785843D+00 -0.610232D+00  0.302726D+01  0.292044D+01
      2  -0.240476D+00 -0.124541D+01 -0.528851D+00 -0.100049D+02  0.296497D+00
      3   0.167644D+01  0.107994D+01 -0.191722D+00 -0.598406D+01 -0.181704D+01
               156           157           158           159           160 
      1   0.410388D+01  0.109364D+01  0.141055D+01 -0.468954D+00  0.338740D+01
      2  -0.266853D+01 -0.549688D+00 -0.715143D+00 -0.674519D+00 -0.642899D+01
      3  -0.329559D+01  0.895798D+00 -0.150482D+00 -0.403241D+00 -0.329897D+01
               161           162           163           164           165 
      1   0.241572D+01  0.353656D+01 -0.169080D+01 -0.462405D+01 -0.402025D+00
      2  -0.232716D+00 -0.234349D+01  0.956484D+01  0.488074D+01 -0.393042D+01
      3  -0.110814D+01 -0.313076D+01  0.580983D+01  0.172427D+01 -0.336981D+01
               166           167           168           169           170 
      1  -0.232369D+01 -0.385893D+01 -0.130610D+01  0.321768D+00  0.226521D+01
      2   0.434034D+01  0.492424D+01 -0.306404D+01 -0.455335D+01 -0.314682D+01
      3   0.455553D+01  0.205681D+01 -0.225857D+01 -0.271750D+01 -0.540471D+00
               171           172           173           174           175 
      1   0.508295D-01  0.419984D+01  0.348146D+01  0.230284D+01  0.232582D+01
      2   0.293606D+01 -0.181626D+02 -0.174073D+01 -0.350877D+01 -0.203777D+01
      3   0.232251D+01 -0.720574D+01 -0.211529D+01 -0.254281D+01  0.599673D+00
               176           177           178           179           180 
      1   0.101562D+01  0.305998D+00  0.223923D+01  0.216852D+01  0.234570D+01
      2  -0.177029D+01 -0.716299D+00 -0.641874D+01 -0.813541D+00 -0.413215D+01
      3  -0.107072D+01 -0.901185D-02 -0.241306D+01 -0.773999D+00 -0.154218D+01
               181           182           183           184           185 
      1  -0.115880D+01 -0.173929D+01 -0.585434D+00 -0.317422D+01 -0.160997D+02
      2  -0.830877D+00  0.105329D+01  0.618480D+00  0.272455D+01 -0.309992D+00
      3  -0.135885D+01 -0.107306D+01  0.101389D+00  0.298557D+01 -0.897325D+01
               186           187           188           189           190 
      1  -0.124927D+01 -0.423875D+00  0.519387D+00 -0.129369D+01  0.524322D+01
      2   0.197328D+01 -0.878317D+00  0.310546D+00  0.448262D+00  0.407838D+01
      3   0.238053D+01 -0.109719D+00 -0.251270D+00 -0.227041D+00  0.377909D+01
               191           192           193           194           195 
      1  -0.384416D+01 -0.497895D+01 -0.297554D+01  0.222453D+01  0.334753D+01
      2  -0.115753D+01  0.510760D+00 -0.238689D+01  0.957090D-01 -0.124648D+01
      3  -0.352668D+01 -0.349790D+01 -0.155281D+01  0.142300D+01  0.211041D+01
               196           197           198           199           200 
      1  -0.418735D+01  0.444977D+01  0.738373D+01 -0.163135D+01  0.702657D+00
      2  -0.481223D+01 -0.365810D-01 -0.896202D+00  0.311436D+01 -0.609745D-01
      3  -0.292909D+01  0.215188D+01  0.387431D+01  0.297813D+01 -0.188388D+01
               201           202           203           204           205 
      1  -0.987482D+00  0.453208D+00 -0.169275D+01  0.145661D+01 -0.128501D+01
      2   0.481427D+01  0.690117D+00  0.360425D+01 -0.645062D+01  0.304908D+01
      3   0.156751D+01 -0.114592D+01  0.223302D+01 -0.414566D+01  0.108877D+01
               206           207           208           209           210 
      1   0.452380D+01 -0.526891D+01  0.180072D+01 -0.830192D+00 -0.924087D+00
      2  -0.550226D+01  0.178529D+02 -0.975279D+01  0.175735D+01  0.944259D+01
      3  -0.562025D+01  0.651725D+01  0.830264D+01 -0.617771D+01 -0.312225D+01
               211           212           213           214           215 
      1  -0.352899D+00  0.815998D+00 -0.283641D+00 -0.176634D+01  0.166723D+01
      2   0.321384D+01 -0.228384D+01 -0.442455D+01  0.820037D+01 -0.284903D+01
      3  -0.492964D+01  0.232266D+01  0.213612D+01 -0.440737D+01  0.446963D+01
               216           217           218           219           220 
      1   0.925740D+00  0.548654D+00  0.334943D+00 -0.422437D+00  0.355861D+00
      2  -0.887337D+01 -0.693105D+00  0.155688D-01  0.184139D+01  0.411530D+00
      3   0.413240D+01 -0.286027D+01 -0.354974D+01 -0.553917D+00 -0.488212D+01
               221           222           223           224           225 
      1   0.268227D+01 -0.370417D+01 -0.503142D+00  0.427860D+00 -0.377500D+00
      2   0.112400D+01  0.366216D+01  0.166783D+01  0.150937D+01  0.119533D+01
      3  -0.237115D+02 -0.179024D+01 -0.109947D+01 -0.163387D+01 -0.148490D+01
               226           227           228           229           230 
      1   0.211195D+01  0.200440D+01 -0.237503D+01  0.142518D+01  0.284626D+01
      2  -0.353840D+01 -0.333266D+01  0.470366D+01 -0.342404D+01 -0.391956D+01
      3  -0.198649D+01 -0.237519D+01  0.787551D+00  0.235375D+01 -0.896693D+01
               231           232           233           234 
      1  -0.365507D+01 -0.165749D+01 -0.395392D+01  0.253769D+01
      2   0.305782D+01  0.349855D+01  0.441641D+01 -0.689186D+01
      3   0.149190D+01  0.529174D+00  0.576644D+01 -0.842116D+00
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.093368:
                 1             2             3             4             5 
      1  -0.749595D+01 -0.100129D+02 -0.656458D+01 -0.342566D+01 -0.631202D+00
      2   0.672111D+01  0.609646D+01  0.923171D+01  0.134926D+01  0.162623D+01
      3   0.774843D+00  0.391643D+01 -0.266713D+01  0.207641D+01 -0.995027D+00
      4  -0.817189D+01 -0.185354D+02  0.311973D+01 -0.455258D+01 -0.233923D+02
      5  -0.100135D+02  0.994458D+00 -0.172171D+02  0.703121D+01  0.489457D+01
      6  -0.123709D+01  0.766406D+01 -0.262063D+01  0.498294D+01  0.433763D+01
                 6             7             8             9            10 
      1   0.787450D+01 -0.777832D+01  0.812504D+01 -0.137540D+02 -0.558060D+01
      2  -0.259823D+01  0.119489D+02 -0.230638D+00  0.114526D+02  0.514630D+01
      3  -0.527627D+01 -0.417060D+01 -0.789440D+01  0.230142D+01  0.434301D+00
      4   0.776066D+01  0.864291D+01  0.180200D+02 -0.117223D+02 -0.121388D+01
      5   0.116528D+01 -0.215663D+02 -0.542059D+01 -0.941907D+01  0.218036D+01
      6  -0.244236D+01 -0.612734D+01 -0.682262D+01  0.189060D+00  0.743086D+01
                11            12            13            14            15 
      1   0.930628D+01 -0.173230D+01  0.128427D+02  0.219610D+02 -0.263367D+01
      2  -0.136142D+02 -0.446644D+00 -0.155520D+02 -0.449106D+02  0.766645D+00
      3   0.430795D+01  0.217895D+01  0.270927D+01  0.229496D+02  0.186703D+01
      4  -0.239834D+01  0.199585D+01  0.170797D+01 -0.140890D+02 -0.648064D+00
      5   0.122157D+01  0.158076D+01  0.117638D+01 -0.366834D+01  0.583518D+00
      6  -0.177787D+01  0.690393D+01 -0.362250D+01 -0.333931D+01  0.429395D+01
                16            17            18            19            20 
      1  -0.218897D+01 -0.444389D+01  0.150609D+02 -0.170880D+02  0.970517D+01
      2  -0.304642D+01  0.111187D+02  0.816779D+01 -0.805171D+01  0.109369D+02
      3   0.523538D+01 -0.667484D+01 -0.232287D+02  0.251397D+02 -0.206421D+02
      4   0.182013D+01 -0.193023D+01  0.392377D+01  0.545997D+02 -0.371043D+02
      5   0.401849D+01  0.883509D+00  0.306381D+01  0.213587D+02 -0.766850D+01
      6   0.602028D+01  0.152702D+01 -0.178863D+02 -0.110379D+02  0.343962D+01
                21            22            23            24            25 
      1   0.115295D+02  0.207391D+02 -0.177433D+02 -0.883405D+01 -0.124284D+00
      2  -0.693931D+01 -0.473803D+00 -0.714520D+01  0.131687D+02 -0.149355D+01
      3  -0.459024D+01 -0.202653D+02  0.248885D+02 -0.433470D+01  0.161783D+01
      4  -0.825967D+01 -0.454111D+02  0.602946D+02 -0.112478D+01 -0.414104D+01
      5  -0.644649D+01 -0.150396D+02  0.324948D+01  0.122929D+02  0.876237D+01
      6   0.858725D+01  0.650165D+01  0.242828D+01 -0.418067D+01  0.146350D+01
                26            27            28            29            30 
      1  -0.356234D+01 -0.435132D+01  0.558565D+01 -0.110936D+02 -0.223002D+02
      2   0.725713D+01 -0.840361D+01  0.656385D+01 -0.776049D+01  0.133546D+02
      3  -0.369479D+01  0.127549D+02 -0.121495D+02  0.188541D+02  0.894561D+01
      4  -0.332976D+01  0.986874D+01 -0.353568D+02  0.433163D+02  0.207656D+02
      5   0.245335D+01 -0.410126D+01 -0.411740D+02  0.177588D+02  0.144317D+02
      6   0.592275D+01 -0.142836D+01  0.213189D+02 -0.136251D+02 -0.797928D+01
                31            32            33            34            35 
      1  -0.134791D+02  0.205570D+02  0.157306D+02 -0.376472D+02  0.260284D+02
      2  -0.113267D+02  0.570998D+01 -0.206759D+02  0.244054D+02 -0.309272D+02
      3   0.248058D+02 -0.262670D+02  0.494537D+01  0.132418D+02  0.489881D+01
      4   0.517054D+02 -0.510264D+02  0.967451D+01  0.172479D+02  0.123773D+02
      5   0.601791D+01  0.103664D+02 -0.938894D+01  0.246080D+02 -0.193981D+02
      6  -0.409545D+01 -0.203251D+02  0.565957D+01 -0.153433D+02  0.145699D+02
                36            37            38            39            40 
      1   0.360295D+01  0.620171D+01 -0.626836D+01  0.272860D+01 -0.106371D+02
      2  -0.376505D+01  0.504216D+01  0.359559D+00 -0.502793D+01 -0.835985D+00
      3   0.162094D+00 -0.112439D+02  0.590880D+01  0.229933D+01  0.114730D+02
      4  -0.185210D+02 -0.321109D+02  0.104975D+02  0.495901D+01  0.522160D+01
      5  -0.105008D+02 -0.421332D+01  0.427081D+00 -0.370897D+00  0.293131D+01
      6  -0.167481D+01  0.516609D+01 -0.809397D+01 -0.371316D+01 -0.802328D+01
                41            42            43            44            45 
      1   0.249286D+02  0.682966D+01  0.148906D+02  0.471316D+01  0.422343D+01
      2  -0.572292D+01 -0.306163D+01 -0.963293D+01 -0.712926D+01  0.982898D-01
      3  -0.192056D+02 -0.376802D+01 -0.525765D+01  0.241609D+01 -0.432172D+01
      4  -0.925125D+01 -0.153195D+01  0.134803D+02 -0.519837D+01 -0.700978D+01
      5  -0.555602D+01  0.300455D+01 -0.652215D+01  0.317743D+01 -0.138343D+01
      6  -0.289400D+01 -0.200646D+02 -0.199171D+01 -0.160879D+02 -0.138341D+01
                46            47            48            49            50 
      1  -0.144720D+02 -0.539691D+01 -0.133349D+02 -0.209326D+01  0.880286D+00
      2   0.756299D+00  0.284431D+01  0.114854D+02  0.647284D+01 -0.490084D+00
      3   0.137157D+02  0.255260D+01  0.184946D+01 -0.437958D+01 -0.390202D+00
      4   0.389052D+01  0.329901D+01 -0.901272D+01  0.443836D+00  0.198027D+02
      5  -0.139808D+02 -0.151477D+01  0.819782D+01 -0.647487D+00 -0.189973D+01
      6  -0.601689D+01  0.438558D+00  0.401053D+01  0.846141D+00 -0.816187D+01
                51            52            53            54            55 
      1  -0.615842D+01 -0.174905D+02 -0.477000D+01  0.916794D+01 -0.345761D+01
      2  -0.312870D+01  0.133196D+02  0.226103D+01 -0.691130D+01 -0.850080D+01
      3   0.928712D+01  0.417095D+01  0.250896D+01 -0.225664D+01  0.119584D+02
      4  -0.166333D+01 -0.199427D+02 -0.691698D-01  0.240934D+01  0.177437D+02
      5  -0.486217D+01  0.105887D+02 -0.446458D+01  0.224766D+01  0.432841D+01
      6   0.281750D+01  0.439494D+01 -0.862151D+00  0.448509D+00 -0.508137D+01
                56            57            58            59            60 
      1   0.142638D+01  0.374310D+01 -0.253120D+01 -0.135640D+02  0.113571D+01
      2   0.131977D+02 -0.494911D+01  0.105572D+02  0.679824D+01  0.504020D+00
      3  -0.146241D+02  0.120601D+01 -0.802599D+01  0.676577D+01 -0.163973D+01
      4  -0.222502D+02 -0.465932D+01 -0.207361D+02  0.104071D+02  0.584100D+01
      5  -0.327603D+01 -0.631238D+00 -0.573228D+01  0.636953D+01  0.244252D+01
      6  -0.173101D+01 -0.827284D+01  0.681833D+00  0.423770D+01 -0.920325D+00
                61            62            63            64            65 
      1   0.325143D+01  0.414737D+01  0.275585D+01  0.607633D+01  0.972331D+01
      2  -0.236920D+01 -0.957111D+01  0.479874D+01  0.641131D+01 -0.654912D+01
      3  -0.882229D+00  0.542374D+01 -0.755459D+01 -0.124876D+02 -0.317419D+01
      4  -0.155481D+01  0.780216D+01 -0.306506D+01  0.179477D+00 -0.502275D+01
      5   0.104838D+01 -0.353314D+00 -0.120634D+01 -0.508902D+01  0.743078D+01
      6  -0.566000D+01  0.277905D+01  0.111712D+02  0.122068D+02  0.150099D+02
                66            67            68            69            70 
      1  -0.324143D+01  0.157221D+02 -0.104308D+02 -0.143958D+01 -0.233495D+00
      2   0.147530D+02 -0.393827D+01  0.401769D+01 -0.679147D+01  0.120235D+02
      3  -0.115116D+02 -0.117838D+02  0.641311D+01  0.823105D+01 -0.117900D+02
      4   0.732234D+01 -0.332008D+01 -0.400516D+01  0.347536D+01  0.133507D+00
      5  -0.171503D+02  0.211153D+01  0.894641D+01 -0.965424D+01 -0.150637D+02
      6  -0.124705D+01  0.136549D+02 -0.126734D+02  0.757732D-01  0.209444D+01
                71            72            73            74            75 
      1  -0.540845D+01 -0.586185D+01  0.235085D+02  0.242506D+01  0.114839D+02
      2   0.677582D+00 -0.230321D+01 -0.180888D+02 -0.198164D+01 -0.120942D+02
      3   0.473086D+01  0.816506D+01 -0.541970D+01 -0.443418D+00  0.610357D+00
      4   0.545091D+01  0.282375D+01  0.844702D+01  0.906443D+01  0.551460D+01
      5  -0.285241D+01 -0.539724D+01  0.207908D+02  0.324155D+01  0.182970D+02
      6  -0.308068D+01  0.199154D+01  0.244836D+01  0.142371D+01  0.342263D+01
                76            77            78            79            80 
      1  -0.425194D+01  0.135245D+01 -0.259337D+01  0.137150D+02 -0.467360D+00
      2   0.415071D+01 -0.846807D+00  0.340551D+01 -0.152073D+02 -0.345850D+00
      3   0.101228D+00 -0.505644D+00 -0.812138D+00  0.149229D+01  0.813209D+00
      4   0.599110D+01  0.104831D+01  0.261202D+01  0.641157D+01  0.341528D+01
      5  -0.304095D+01  0.374761D+01 -0.232123D+01  0.227886D+02  0.496006D+01
      6   0.213167D+01 -0.372656D-01  0.369727D+01  0.384591D+01  0.476790D+01
                81            82            83            84            85 
      1   0.769137D+01 -0.599896D+00 -0.269899D+01 -0.329293D+00 -0.397611D+01
      2  -0.164693D+02  0.690079D+01  0.876056D+01  0.894642D+00  0.101940D+02
      3   0.877796D+01 -0.630089D+01 -0.606156D+01 -0.565349D+00 -0.621787D+01
      4   0.796631D+01  0.688663D+01  0.138435D+02  0.747271D+00  0.112288D+02
      5   0.263519D+02  0.155435D+01  0.227768D+01  0.181739D+01  0.191661D+01
      6   0.518600D+01  0.849775D+00  0.243815D+01  0.627022D+00  0.328917D+01
                86            87            88            89            90 
      1  -0.397799D+02 -0.346519D+01  0.372245D+00  0.265162D+01 -0.551040D+01
      2   0.734987D+02  0.323724D+01 -0.889635D+00 -0.769544D+01  0.471896D+01
      3  -0.337188D+02  0.227950D+00  0.517390D+00  0.504382D+01  0.791446D+00
      4   0.224755D+02  0.198509D+01 -0.151583D+01 -0.235697D+01  0.143375D+01
      5   0.299681D+01  0.183445D+01  0.958261D+00  0.191303D+01 -0.125893D+00
      6   0.140947D+02  0.875306D+01  0.360715D+00  0.829294D+01  0.158559D+01
                91            92            93            94            95 
      1  -0.107165D+01  0.101200D+01  0.354324D+01 -0.167563D+01 -0.572989D+01
      2  -0.359701D+01 -0.247095D+00  0.756075D-02  0.826671D+00  0.528389D+01
      3   0.466867D+01 -0.764903D+00 -0.355080D+01  0.848960D+00  0.446004D+00
      4  -0.186154D+01  0.298300D+01  0.306561D+01  0.551914D+00 -0.244884D-01
      5  -0.200583D+01  0.878940D+00  0.623483D+01 -0.312181D+00 -0.110716D+00
      6   0.234176D+01 -0.240270D+01 -0.480031D+01 -0.995483D+00  0.361892D+01
                96            97            98            99           100 
      1  -0.161725D+01  0.433586D+01 -0.818644D+01 -0.254601D+02  0.626707D+02
      2   0.361369D+01  0.106801D+01  0.295917D+01 -0.130481D+02 -0.288780D+02
      3  -0.199644D+01 -0.540388D+01  0.522727D+01  0.385081D+02 -0.337927D+02
      4  -0.118570D+00  0.345572D+01  0.328327D+00 -0.124776D+00 -0.327674D+02
      5  -0.473831D+00  0.501926D+01  0.675622D+00  0.214933D+01  0.181415D+02
      6   0.504207D+01 -0.262224D+01  0.121448D+02  0.292661D+02 -0.105783D+02
               101           102           103           104           105 
      1  -0.112617D+02  0.155247D+02 -0.535643D+00  0.501142D+01  0.892418D+00
      2   0.158654D+01 -0.776323D+01 -0.404036D+01  0.227937D+01 -0.247592D+00
      3   0.967511D+01 -0.776147D+01  0.457600D+01 -0.729079D+01 -0.644825D+00
      4   0.177783D+02 -0.100516D+02  0.130945D+02 -0.101133D+02 -0.233357D+00
      5  -0.592068D+01  0.111269D+02  0.302461D+01 -0.114604D+01 -0.254039D+00
      6   0.405149D+01 -0.572627D+01 -0.441315D+00  0.151548D+01  0.162370D+01
               106           107           108           109           110 
      1   0.310793D+02 -0.798050D+01  0.849327D+01  0.302513D+01 -0.101001D+02
      2  -0.171948D+02  0.427843D+01 -0.671831D+01  0.246452D+01  0.700726D+01
      3  -0.138845D+02  0.370208D+01 -0.177497D+01 -0.548964D+01  0.309284D+01
      4  -0.143329D+02  0.297230D+01 -0.348204D+01 -0.559357D+01  0.489295D+01
      5   0.982915D+01 -0.127432D+00  0.964124D+01  0.155305D+01 -0.251381D+01
      6  -0.394322D+01  0.126257D+01 -0.373508D+01  0.180997D+00  0.610431D+01
               111           112           113           114           115 
      1  -0.258975D+01 -0.323207D+01 -0.254694D+02 -0.103140D+02  0.148582D+01
      2   0.264268D+01 -0.218957D+01  0.427181D+02  0.130110D+02 -0.272413D+01
      3  -0.529317D-01  0.542164D+01 -0.172487D+02 -0.269696D+01  0.123831D+01
      4  -0.230694D+01  0.127450D+02 -0.314238D+02 -0.114856D+02  0.121326D+00
      5  -0.828324D+00  0.360870D+01 -0.137663D+02 -0.824171D+01  0.535087D-01
      6   0.335099D+01 -0.381067D+01  0.221929D+02  0.129749D+02  0.599547D+00
               116           117           118           119           120 
      1  -0.161610D+02 -0.940797D+01 -0.334978D+00 -0.126614D+01 -0.145714D+01
      2   0.205317D+02  0.721932D+01  0.254326D+00  0.384784D+00  0.173578D+00
      3  -0.437062D+01  0.218865D+01  0.806519D-01  0.881352D+00  0.128356D+01
      4  -0.120815D+02 -0.413734D+01  0.255971D+01  0.709288D+01  0.339002D+01
      5  -0.568611D+01 -0.477540D+01  0.908350D+00  0.440579D+01  0.535719D+01
      6   0.118321D+02  0.968051D+01  0.479965D+01  0.186613D+01  0.281219D+01
               121           122           123           124           125 
      1  -0.286263D+01 -0.178611D+02 -0.128634D+02 -0.620088D+00 -0.102617D+02
      2   0.160974D+01  0.145587D+02  0.542836D+01  0.533738D+00  0.242095D+01
      3   0.125289D+01  0.330243D+01  0.743501D+01  0.863499D-01  0.784076D+01
      4   0.623287D+01  0.500926D+01  0.276278D+01  0.848428D+00  0.212617D+01
      5   0.349348D+01  0.137700D+01  0.177992D+01  0.323387D+01  0.142199D+01
      6   0.205492D+01  0.222653D+02  0.188129D+02  0.248240D+01  0.162189D+02
               126           127           128           129           130 
      1  -0.147420D+02  0.117397D+02  0.391707D+01  0.681347D+01  0.607498D+01
      2  -0.109442D+01  0.109423D+02 -0.649145D+01 -0.128936D+02 -0.130002D+02
      3   0.158364D+02 -0.226820D+02  0.257438D+01  0.608014D+01  0.692520D+01
      4   0.324319D+01  0.744669D+01  0.647466D+00  0.381511D+01 -0.132056D+01
      5   0.122653D+01  0.592337D+01 -0.493740D+01 -0.206016D+02 -0.651160D+01
      6   0.162002D+02 -0.178180D+00  0.361353D+01  0.202973D+01  0.565828D+01
               131           132           133           134           135 
      1   0.929107D+01  0.265224D+01  0.655048D+01  0.550930D+01 -0.126139D+02
      2  -0.238961D+02  0.137112D+02 -0.118094D+02  0.540658D+01  0.125822D+02
      3   0.146050D+02 -0.163634D+02  0.525895D+01 -0.109159D+02  0.317203D-01
      4  -0.183918D+02  0.201560D+01  0.557398D+01  0.784490D-01  0.168928D+01
      5   0.446942D+01  0.100470D+02 -0.208284D+02  0.585300D+01  0.107848D+02
      6   0.213043D+02  0.872412D+00  0.995153D+00  0.485723D+01 -0.123856D+02
               136           137           138           139           140 
      1  -0.280187D+00  0.161650D+02  0.243219D+02  0.226732D+02  0.216452D+00
      2   0.275293D+01 -0.122616D+02 -0.120305D+02 -0.205199D+02 -0.144542D+02
      3  -0.247274D+01 -0.390340D+01 -0.122914D+02 -0.215335D+01  0.142378D+02
      4   0.149170D+02 -0.542785D+01  0.250817D+01 -0.121269D+02 -0.357498D+02
      5   0.258680D+02 -0.102993D+01 -0.137504D+02 -0.281990D+01 -0.412703D+01
      6   0.404581D+01 -0.664527D+00 -0.130626D+01 -0.185717D+01 -0.570188D+01
               141           142           143           144           145 
      1  -0.120300D+01  0.310286D+02 -0.180883D+01 -0.188961D+02  0.150500D+02
      2  -0.187936D+01 -0.151533D+02 -0.237484D+01  0.166847D+02  0.395712D+01
      3   0.308236D+01 -0.158753D+02  0.418367D+01  0.221138D+01 -0.190072D+02
      4  -0.353240D+01  0.389454D+01 -0.337685D+01  0.117810D+02 -0.305462D+02
      5   0.150463D+02 -0.205395D+02  0.136955D+02 -0.154802D+02 -0.394706D+01
      6   0.189107D+01 -0.195424D+01  0.268108D+01 -0.154868D+01  0.183753D+01
               146           147           148           149           150 
      1  -0.480639D+01 -0.187620D+01 -0.109671D+01 -0.432322D+01 -0.635323D+00
      2  -0.115075D+02  0.669033D-01 -0.120312D+02  0.224532D+02  0.299427D+01
      3   0.163139D+02  0.180930D+01  0.131279D+02 -0.181300D+02 -0.235895D+01
      4   0.278596D+02  0.375628D+01  0.236278D+02 -0.268147D+02 -0.347145D+01
      5   0.229113D+01  0.545165D+01  0.187460D+01 -0.269254D+01 -0.244172D+01
      6  -0.163841D+01 -0.303861D+01 -0.141941D+01  0.253064D+01  0.623213D+01
               151           152           153           154           155 
      1  -0.150197D+01 -0.648669D+00 -0.110541D+01  0.337556D+01  0.233200D+01
      2  -0.411685D-01  0.351858D+01  0.240418D+01 -0.126955D+02  0.118879D-01
      3   0.154314D+01 -0.286991D+01 -0.129876D+01  0.931990D+01 -0.234389D+01
      4   0.376954D+01 -0.386580D+01 -0.536908D+01 -0.468442D+01  0.436818D+01
      5   0.559541D+01 -0.432727D+01 -0.217352D+01  0.201264D+02 -0.499869D+01
      6  -0.398804D+01  0.783047D+01  0.107293D+01 -0.897893D+01  0.498497D+01
               156           157           158           159           160 
      1  -0.402417D+01 -0.116251D+01 -0.511852D+00  0.824943D+00 -0.288862D+01
      2  -0.124608D+02 -0.840310D+00 -0.113990D+01 -0.164509D+01 -0.109627D+02
      3   0.164850D+02  0.200282D+01  0.165175D+01  0.820148D+00  0.138514D+02
      4  -0.547770D+01  0.487406D+01 -0.139504D+01  0.258591D+01 -0.402638D+01
      5   0.191779D+02 -0.129419D+01  0.336772D+01 -0.713165D+00  0.169394D+02
      6  -0.962739D+01  0.289838D+01 -0.216392D+01  0.684104D+01 -0.670793D+01
               161           162           163           164           165 
      1   0.367685D+01 -0.111667D+02 -0.329539D+01 -0.769704D+01  0.856899D+01
      2   0.885890D+00 -0.164661D+02 -0.128821D+01  0.436390D+01  0.118765D+01
      3  -0.456274D+01  0.276328D+02  0.458360D+01  0.333314D+01 -0.975664D+01
      4   0.212541D+01 -0.377460D+01  0.837871D+01  0.815486D+01 -0.675763D+01
      5  -0.295923D+01  0.201905D+02 -0.114448D+02 -0.765013D+01  0.124830D+02
      6   0.749935D+01 -0.126378D+02 -0.980494D+01 -0.134854D+02  0.125700D+02
               166           167           168           169           170 
      1  -0.497452D+01 -0.102377D+02  0.917913D+01  0.386072D+01  0.754158D+01
      2   0.283201D+01  0.958733D+01 -0.163274D+01  0.663273D+00 -0.205749D+00
      3   0.214251D+01  0.650336D+00 -0.754639D+01 -0.452399D+01 -0.733583D+01
      4   0.740432D+01  0.603987D+01 -0.473257D+01 -0.443708D+01 -0.405901D+01
      5  -0.550678D+01 -0.683211D+01  0.522947D+01  0.871093D+01  0.474564D+01
      6  -0.865326D+01 -0.140109D+02  0.146933D+02  0.619809D+01  0.120483D+02
               171           172           173           174           175 
      1  -0.108799D+02 -0.468589D+01  0.842211D+00 -0.102857D+02 -0.103804D+01
      2  -0.329476D+01 -0.424539D+01 -0.640609D+00 -0.368971D+01  0.140989D+01
      3   0.141747D+02  0.893128D+01 -0.201602D+00  0.139754D+02 -0.371843D+00
      4   0.457381D+01 -0.919998D+01  0.406213D+00 -0.195901D+01  0.130748D+01
      5  -0.770613D+01  0.131527D+02  0.166844D+01  0.793287D+01  0.199055D+01
      6  -0.147053D+02  0.111080D+00  0.426478D+01 -0.544025D+01  0.226571D+01
               176           177           178           179           180 
      1  -0.296688D+01 -0.493156D+00 -0.629261D+01 -0.117609D+00 -0.632337D+01
      2   0.336076D+01 -0.280188D+01 -0.256274D+01 -0.113175D+01 -0.619432D+01
      3  -0.393879D+00  0.329503D+01  0.885535D+01  0.124936D+01  0.125177D+02
      4   0.110336D+01  0.161742D+00 -0.210381D+01  0.340712D+00 -0.320859D+01
      5   0.170707D+01 -0.181172D+01  0.946273D+01 -0.852378D-01  0.479041D+01
      6  -0.151045D+01  0.238509D+01 -0.232563D+01  0.246469D+01 -0.176716D+01
               181           182           183           184           185 
      1  -0.403795D+00  0.154242D+01 -0.570274D+00 -0.811397D+00 -0.206890D+02
      2   0.153164D+01  0.160020D+01  0.159607D+01  0.547091D+01  0.376517D+02
      3  -0.112784D+01 -0.314262D+01 -0.102579D+01 -0.465951D+01 -0.169628D+02
      4   0.430595D+01  0.812856D+01 -0.236551D+01  0.104220D+02  0.212780D+02
      5  -0.264196D+01 -0.329098D+01  0.510055D+01 -0.429566D+01 -0.590914D+01
      6  -0.309486D+01 -0.316922D+01  0.112719D+01 -0.600767D+01 -0.300209D+02
               186           187           188           189           190 
      1   0.804029D+01  0.387712D+00  0.203442D+01 -0.231397D+01  0.847123D+01
      2  -0.556711D+01  0.182212D+01  0.144310D+01  0.125654D+01 -0.170067D+02
      3  -0.247318D+01 -0.220983D+01 -0.347752D+01  0.105742D+01  0.853552D+01
      4  -0.526073D+01  0.991884D-01  0.558473D+00  0.215981D+01  0.249650D+01
      5   0.406889D+01  0.317710D+01  0.143224D+01 -0.196998D+01 -0.229897D+02
      6   0.136694D+02  0.118429D+01  0.650791D+01 -0.302302D+01 -0.295746D+00
               191           192           193           194           195 
      1  -0.214854D+01 -0.128323D+01 -0.327592D+01 -0.756243D+00 -0.165192D+01
      2   0.373410D+01  0.164491D+02  0.685100D+01 -0.934672D+00 -0.865512D+01
      3  -0.158556D+01 -0.151659D+02 -0.357508D+01  0.169091D+01  0.103070D+02
      4   0.366140D+01 -0.324509D+01  0.288708D+01 -0.659258D+00 -0.301110D+01
      5   0.276562D+01  0.245961D+02  0.842239D+01 -0.574859D+01 -0.960862D+01
      6  -0.517588D+01  0.193758D+01 -0.443210D+01  0.187205D+01  0.511212D+01
               196           197           198           199           200 
      1  -0.120910D+01 -0.436359D+00 -0.632823D+01  0.893877D+01 -0.434490D+01
      2   0.136429D+02 -0.368737D+01 -0.221294D+02 -0.800307D+01  0.325256D+01
      3  -0.124338D+02  0.412373D+01  0.284577D+02 -0.935692D+00  0.109234D+01
      4  -0.216187D+01 -0.265416D+01  0.164909D+01 -0.328169D+01  0.259915D+01
      5   0.201916D+02 -0.322055D+01 -0.261157D+02  0.876166D+01 -0.295388D+01
      6   0.547941D+00  0.525948D+01 -0.699745D+00 -0.442781D+00  0.499227D+00
               201           202           203           204           205 
      1   0.620200D+01 -0.999117D+01  0.987851D+00 -0.191267D+01  0.125951D+02
      2  -0.633303D+01  0.674066D+01 -0.302218D+00  0.364870D+01 -0.109231D+02
      3   0.131030D+00  0.325051D+01 -0.685633D+00 -0.173603D+01 -0.167204D+01
      4  -0.157509D+01  0.446050D+01 -0.194084D+01  0.623114D+01  0.281956D+00
      5   0.138035D+02 -0.499993D+01  0.604443D+01 -0.100785D+02  0.206728D+02
      6   0.525152D+00  0.889642D+00 -0.135877D+01  0.244107D+01  0.238819D+01
               206           207           208           209           210 
      1  -0.312638D+00  0.685973D+01  0.531723D+02 -0.903007D+01 -0.180013D+02
      2   0.345517D+01 -0.170833D+02 -0.290564D+02  0.565976D+01  0.102541D+02
      3  -0.314253D+01  0.102236D+02 -0.241159D+02  0.337031D+01  0.774716D+01
      4   0.783122D+01 -0.527886D+01 -0.263800D+01  0.810116D+01  0.113661D+01
      5  -0.722957D+01  0.334238D+02 -0.193834D+02  0.301769D+01  0.151356D+02
      6   0.287965D+01  0.325156D+01 -0.190760D+01 -0.377460D-01  0.165604D+01
               211           212           213           214           215 
      1  -0.190267D+02  0.716905D+01  0.466188D+01 -0.329343D+02  0.375476D+01
      2   0.112966D+02 -0.192837D+01 -0.265065D+01  0.191670D+02 -0.245587D+01
      3   0.773005D+01 -0.524068D+01 -0.201123D+01  0.137673D+02 -0.129889D+01
      4   0.107391D+02 -0.243336D+01 -0.409798D+01 -0.861425D+00 -0.647971D+01
      5   0.592965D+01 -0.396709D+01 -0.719483D+01  0.213214D+02 -0.488056D+01
      6  -0.695882D+00  0.140174D+01  0.125424D+01  0.161966D+01  0.115544D+01
               216           217           218           219           220 
      1   0.144422D+02  0.649063D+01  0.572951D+01 -0.124016D+01  0.972229D+01
      2  -0.119147D+02 -0.597383D-02 -0.552002D+00  0.995374D+00  0.428606D+01
      3  -0.252752D+01 -0.648466D+01 -0.517751D+01  0.244787D+00 -0.140083D+02
      4  -0.283935D+01  0.829676D+01  0.118180D+02  0.113502D+01  0.263440D+02
      5  -0.165619D+02 -0.774797D+00  0.176612D+01  0.305666D+01  0.403480D+01
      6  -0.130416D+01  0.849007D+00  0.868049D+00  0.242007D+00  0.327412D+01
               221           222           223           224           225 
      1  -0.450574D+01  0.283708D+00 -0.313426D+01 -0.257115D+00  0.112419D+01
      2   0.263128D+02  0.822800D+00  0.140230D+01  0.804311D+00  0.268451D+00
      3  -0.218071D+02 -0.110651D+01  0.173195D+01 -0.547195D+00 -0.139264D+01
      4   0.483009D+02  0.436616D+01  0.113839D+01  0.286794D+01  0.442978D+01
      5   0.455825D+01  0.637628D+01  0.632725D+01  0.437037D+01  0.296935D+01
      6   0.763668D+01  0.662847D+01  0.279120D+01  0.620154D+01  0.151991D+01
               226           227           228           229           230 
      1   0.162373D+02  0.115182D+02 -0.511311D+01  0.754330D+01  0.272338D+01
      2  -0.591585D+01 -0.295028D+01  0.127790D+01  0.219731D+00  0.615757D+01
      3  -0.103215D+02 -0.856787D+01  0.383521D+01 -0.776303D+01 -0.888095D+01
      4   0.194171D+02  0.224088D+02 -0.644115D+01  0.153112D+02  0.270899D+02
      5  -0.660262D+01 -0.327101D+01  0.766038D+01 -0.336321D+01 -0.667103D+01
      6  -0.493201D+01 -0.486461D+01  0.396982D+01 -0.468838D+01 -0.611879D+01
               231           232           233           234 
      1  -0.303662D+01 -0.976693D+01 -0.410612D+01  0.566305D+01
      2  -0.148351D+01  0.375584D+01 -0.200974D+01 -0.348611D+01
      3   0.452013D+01  0.601109D+01  0.611586D+01 -0.217695D+01
      4  -0.817329D+01 -0.118415D+02 -0.208932D+02  0.105812D+02
      5   0.317369D+01  0.100461D+02  0.756240D+01 -0.953557D+01
      6   0.628242D+01  0.581663D+01  0.833288D+01 -0.626384D+01

 ----------------------------------------------------------------------

 Electric dipole moment (input orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.286513D+00      0.728243D+00      0.242916D+01
   x         -0.168839D+00     -0.429147D+00     -0.143148D+01
   y          0.226577D+00      0.575901D+00      0.192100D+01
   z          0.473898D-01      0.120453D+00      0.401787D+00

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.112325D+03      0.166448D+02      0.185199D+02
   aniso      0.232743D+02      0.344890D+01      0.383742D+01
   xx         0.122601D+03      0.181675D+02      0.202141D+02
   yx        -0.680292D+01     -0.100809D+01     -0.112165D+01
   yy         0.114486D+03      0.169651D+02      0.188763D+02
   zx         0.723190D+00      0.107166D+00      0.119238D+00
   zy         0.113236D+01      0.167799D+00      0.186701D+00
   zz         0.998872D+02      0.148018D+02      0.164692D+02

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  488.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.117820D+03      0.174592D+02      0.194260D+02
   aniso      0.254600D+02      0.377278D+01      0.419779D+01
   xx         0.128833D+03      0.190911D+02      0.212417D+02
   yx        -0.786079D+01     -0.116485D+01     -0.129607D+01
   yy         0.120183D+03      0.178092D+02      0.198154D+02
   zx         0.386789D+00      0.573162D-01      0.637728D-01
   zy         0.111981D+01      0.165939D+00      0.184632D+00
   zz         0.104445D+03      0.154772D+02      0.172207D+02

 ----------------------------------------------------------------------

 Dipole orientation:
     6          3.33100666          1.44816817         -0.61672476
     6          2.77415654          0.63443705          2.14191318
     6          1.13438583          0.99788014         -2.40675749
     6          1.42459406          0.70720937         -4.88421922
     6         -1.38923463          0.90353706         -1.12383393
     6         -1.41208659         -1.34937142          0.82114988
     6         -0.06958325          0.54123161          2.65117599
     6         -1.37968134          2.71407979          1.18912524
     1          5.03469097          0.53452756         -1.33097481
     1          3.66353713          1.97073413          3.43941300
     1          3.60920599         -1.20909455          2.54050336
     1          3.27635778          0.71341487         -5.75842682
     1         -0.18634061          0.46131706         -6.12263668
     1         -2.94951664          1.00303233         -2.46655509
     6         -0.07228597         -3.78657803          0.09461033
     6         -4.09007279         -1.98614496          1.69035016
     1         -0.47404998          0.33014532          4.66334082
     1         -3.27255609          3.11748811          1.87343031
     1         -0.35499570          4.48996516          0.99710201
     1          1.82453921         -3.48426918         -0.63741466
     1         -1.13875948         -4.77312340         -1.37294088
     1          0.06148988         -5.04786272          1.72557715
     1         -5.17006994         -0.32631715          2.25201642
     1         -4.02811122         -3.26930168          3.30780736
     1         -5.13111708         -2.93281434          0.17910265
     1          3.72850942          3.47546463         -0.63009167

 Electric dipole moment (dipole orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.286513D+00      0.728243D+00      0.242916D+01
   x          0.000000D+00      0.000000D+00      0.000000D+00
   y          0.000000D+00      0.000000D+00      0.000000D+00
   z          0.286513D+00      0.728243D+00      0.242916D+01

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.112325D+03      0.166448D+02      0.185199D+02
   aniso      0.232743D+02      0.344890D+01      0.383742D+01
   xx         0.110728D+03      0.164082D+02      0.182566D+02
   yx         0.550057D+01      0.815101D+00      0.906922D+00
   yy         0.102846D+03      0.152401D+02      0.169569D+02
   zx        -0.651804D+01     -0.965875D+00     -0.107468D+01
   zy        -0.532585D+00     -0.789209D-01     -0.878113D-01
   zz         0.123401D+03      0.182861D+02      0.203460D+02

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  488.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.117820D+03      0.174592D+02      0.194260D+02
   aniso      0.254600D+02      0.377278D+01      0.419779D+01
   xx         0.115415D+03      0.171028D+02      0.190294D+02
   yx         0.577616D+01      0.855938D+00      0.952360D+00
   yy         0.107746D+03      0.159663D+02      0.177649D+02
   zx        -0.711781D+01     -0.105475D+01     -0.117357D+01
   zy        -0.727961D+00     -0.107873D+00     -0.120025D+00
   zz         0.130300D+03      0.193085D+02      0.214836D+02

 ----------------------------------------------------------------------
 1\1\GINC-CPN-K08-02-01\Freq\RB3LYP\Gen\C10H16\PIERPA\16-Jul-2021\0\\#P
  B3LYP/Gen EmpiricalDispersion=GD3BJ Integral=UltraFineGrid SCF=(NoSym
 m,MaxCyc=120) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq\\ROA calcula
 tions.\\0,1\C,1.736209,0.801878,0.378732\C,0.496901,1.63894,0.787068\C
 ,1.383096,-0.522443,-0.274501\C,2.201969,-1.569072,-0.279208\C,0.02555
 6,-0.542713,-0.909694\C,-1.066183,-0.286051,0.196211\C,-0.738063,1.227
 45,-0.016143\C,-0.309046,0.871194,-1.461941\H,2.398518,0.639455,1.2298
 3\H,0.705457,2.697786,0.618767\H,0.29272,1.53039,1.853834\H,3.163814,-
 1.541544,0.219131\H,1.937671,-2.4885,-0.787055\H,-0.114313,-1.410379,-
 1.555412\C,-0.857617,-0.90421,1.570339\C,-2.466835,-0.645129,-0.296336
 \H,-1.560459,1.932149,0.122182\H,-1.140268,0.855938,-2.161136\H,0.5072
 86,1.44313,-1.90238\H,0.139287,-0.735039,1.971262\H,-1.004924,-1.98593
 ,1.522168\H,-1.583414,-0.502658,2.282629\H,-2.691969,-0.231611,-1.2785
 62\H,-3.219726,-0.26979,0.40153\H,-2.582631,-1.729976,-0.357089\H,2.31
 7034,1.377511,-0.34686\\Version=ES64L-G16RevA.03\State=1-A\HF=-390.845
 2859\RMSD=8.522e-09\RMSF=1.293e-05\ZeroPoint=0.2360996\Thermal=0.24568
 72\Dipole=-0.1688393,0.2265768,0.0473898\DipoleDeriv=0.0869201,-0.0642
 104,-0.0317927,0.0191885,-0.0371539,-0.0628745,-0.0527401,-0.0240724,0
 .1452395,0.0493493,0.010286,-0.0287934,-0.0255389,0.1333633,-0.0222651
 ,-0.0215761,-0.0252419,0.1241743,0.2531092,-0.162628,0.0545244,-0.1563
 49,0.2753323,0.0857669,0.1559054,0.0600653,-0.1082239,-0.1753469,0.133
 9755,0.1734556,0.1203384,-0.2097972,0.0961884,0.1455314,0.1054697,-0.1
 995229,-0.1257896,0.0251309,-0.015331,0.0878937,0.1116025,0.0984589,0.
 0861029,0.0399781,0.0883214,0.093645,0.0657728,-0.0024479,-0.0272694,0
 .0346125,-0.0976219,-0.0285783,-0.0432662,0.1512393,0.1461038,-0.08692
 3,-0.0020506,-0.1485396,0.1277472,0.0431285,-0.0459927,0.0499512,0.005
 9147,0.0982276,0.0873051,0.014699,0.0821869,0.0073615,-0.0436967,-0.07
 78332,-0.0352034,0.0047002,-0.0496951,0.020602,-0.0711354,0.0684883,0.
 0276174,0.0239897,-0.110844,-0.0283548,-0.0544043,-0.0047501,-0.055211
 3,0.0021251,-0.0396247,-0.1949059,-0.0148718,0.0099387,0.0465022,0.046
 4593,-0.0079386,0.0202425,0.0266469,0.0221933,0.0542063,0.0343888,0.03
 74514,-0.0342419,-0.1649983,-0.0725649,0.0396386,-0.0850638,-0.0169212
 ,0.0536604,-0.0496693,-0.1266505,-0.0216743,0.0770864,0.0474632,-0.055
 413,-0.0706588,0.0148405,-0.0554179,-0.0757944,-0.0470311,-0.0969309,0
 .0704769,0.0026557,-0.0047824,-0.0103823,-0.0052793,-0.1368651,-0.1118
 16,-0.0212186,-0.0744772,-0.0412402,0.0253488,-0.0154594,-0.0414297,-0
 .0068726,0.0516619,0.0580972,-0.0323084,0.0663599,-0.0463018,0.0179377
 ,-0.0065081,-0.05939,-0.0071347,0.0913189,0.0145627,0.0074519,0.007628
 ,0.0540531,-0.1327372,0.1370665,0.0305226,0.0959469,-0.0910612,-0.0277
 446,0.0173222,-0.0369149,0.0097923,-0.0720959,0.0245708,-0.1276773,0.0
 179236,0.0338734,-0.0147076,-0.1016516,0.0070159,-0.0455745,-0.0615842
 ,-0.1107076,0.1168945,-0.0666417,-0.03568,0.0762372,0.050465,0.0443036
 ,-0.0089695,-0.0973574,-0.0220632,-0.0866993,-0.0309535,0.0524563,-0.0
 112709,-0.0779938,-0.000521,0.0172185,0.0563867,-0.0280411,0.0043316,-
 0.0517746,-0.1497501,0.0385606,-0.0008161,-0.0333059,0.0361195,-0.0477
 798,0.0429296,0.1206559,0.0673672,0.0279577,-0.0644279,0.0937432,-0.01
 18171,-0.05401,0.0488482,0.0057215,-0.023862,0.0340053,0.0307852,0.078
 6942,-0.0776378,0.0580212,-0.113596,-0.1040091,0.0200708,0.0645612,0.0
 567401,0.0299288,-0.057231,0.1218594,-0.0459842,-0.0314093,0.0143285,0
 .0034251,0.0014988,-0.0845261,-0.161459,-0.0167615,-0.0093075,-0.00488
 56,0.06153,0.0113251,-0.0247901,0.0467985,-0.0196873,-0.0713955,0.0226
 802,0.1064085,0.0315966,-0.0240748\Polar=122.6006738,-6.802916,114.486
 4802,0.7231903,1.132361,99.8872265\Quadrupole=-0.1282431,0.3897365,-0.
 2614935,0.7797574,0.8904938,0.3784129\PG=C01 [X(C10H16)]\NImag=0\\0.51
 172995,0.01909831,0.45438876,0.04335546,-0.04678387,0.55087995,-0.1295
 5476,0.03165711,0.01744570,0.42394162,0.03484634,-0.09857641,-0.016367
 53,0.03589724,0.55677604,0.01750228,-0.01256854,-0.08556287,-0.0281043
 9,-0.02461841,0.56170496,-0.09312291,-0.01978232,-0.01583926,0.0095286
 7,0.02432848,0.01036666,0.58532616,-0.01877996,-0.15349231,-0.03975283
 ,0.00406210,-0.02119398,-0.00633017,-0.21284323,0.67131110,-0.01462372
 ,-0.03880447,-0.09515684,0.00068494,-0.00827498,-0.00431572,0.09636781
 ,0.07805571,0.26964938,0.00999455,-0.00412334,0.00000801,-0.00107031,-
 0.00220761,-0.00102309,-0.26105370,0.21590391,-0.01810625,0.61713806,0
 .01584463,-0.03081636,-0.00442723,-0.00301427,-0.00237191,-0.00132817,
 0.21437212,-0.36562308,-0.01862177,-0.17142710,0.69800660,0.00708299,-
 0.01339303,0.00475941,-0.00076653,-0.00270139,-0.00047021,-0.01955385,
 -0.01777903,-0.07020885,0.19156689,0.15418959,0.25974044,-0.00752346,-
 0.00493198,-0.00920776,0.00059399,0.00012744,0.00010619,-0.16658989,-0
 .00361527,-0.04621992,-0.02702534,0.00983453,-0.01368284,0.43115824,-0
 .02447191,-0.00183210,-0.01392165,-0.00089669,0.00047844,0.00020067,-0
 .00874094,-0.08746627,-0.01279829,0.02905265,0.00229910,0.01069469,-0.
 00652877,0.56239877,-0.01539526,-0.00633470,-0.00699848,-0.00077818,0.
 00100362,-0.00066565,-0.05666243,-0.00902119,-0.10076341,-0.00271345,0
 .00001746,0.00740300,0.06856691,0.14256028,0.43734924,0.00181591,0.000
 18797,-0.00055052,-0.00930070,-0.02701773,0.00672468,-0.03581458,0.002
 21849,0.01797794,0.00094340,-0.00312057,-0.00069639,-0.08645768,0.0051
 3467,0.02424589,0.47080973,-0.00012900,0.00062544,0.00018033,-0.010892
 73,-0.01221014,-0.00271400,0.00744200,-0.00024146,0.00337924,-0.001340
 24,0.00114384,-0.00026307,-0.00049174,-0.05246810,-0.01958647,0.037004
 26,0.42699937,0.00021753,0.00057434,0.00029155,-0.00531279,-0.01717066
 ,0.00534327,0.00321288,-0.00103577,0.01591665,-0.00360969,0.00265392,-
 0.00353147,0.01266955,-0.01462651,-0.09775888,0.01898400,-0.05799252,0
 .49139759,-0.02883967,-0.00034367,-0.01356224,-0.14132448,-0.01792886,
 -0.04017615,0.00044358,-0.00048972,-0.00096954,0.00015875,-0.00058911,
 -0.00014916,-0.00226000,0.03290676,0.02299526,-0.07340804,-0.00756490,
 -0.00904269,0.54155780,0.01592366,0.00544371,0.01129358,-0.01687234,-0
 .08715757,-0.01584975,0.00162454,0.00055777,0.00124037,-0.00077603,-0.
 00044989,-0.00051425,0.02119139,-0.06008233,-0.03341694,-0.00692492,-0
 .13281436,0.01042773,-0.11217400,0.50738513,0.00241619,0.00599181,0.00
 450926,-0.04043481,-0.01608104,-0.10254721,0.00104152,0.00023206,0.000
 68425,-0.00076810,-0.00033469,-0.00033065,0.01346456,-0.02669056,-0.01
 244589,-0.01210586,0.01759122,-0.05945748,-0.00142699,0.06796060,0.407
 27635,-0.00002679,0.00052186,-0.00165753,0.00715434,-0.00096389,-0.027
 16041,-0.00852641,0.02995806,-0.01961526,-0.00344190,-0.00157063,-0.00
 195894,-0.07004951,0.00859860,-0.01935305,-0.00226951,-0.01715364,0.03
 542091,-0.08846977,0.00341580,0.02413283,0.59085418,0.00074201,0.00109
 073,-0.00084461,-0.00001153,-0.00030138,-0.01260535,0.01089722,-0.0028
 2663,0.00743448,-0.00264405,0.00090237,0.00010955,0.00461326,-0.136345
 06,0.02519952,-0.01050000,-0.02498811,0.03921289,0.00865038,-0.0539518
 8,-0.02599251,0.09752104,0.39914292,-0.00194436,-0.00049438,0.00000621
 ,-0.00219683,-0.00086089,-0.02774410,-0.00373658,0.01371597,-0.0092206
 2,-0.00186033,-0.00047309,-0.00072975,-0.02134118,0.02276103,-0.064561
 18,0.01954081,0.02991126,-0.04673583,0.02220800,-0.02156903,-0.1385911
 2,0.04078121,-0.08001068,0.52126605,-0.13764525,0.02562822,-0.12246009
 ,-0.01575616,0.00291234,-0.01895972,-0.00711349,-0.00149174,-0.0078653
 7,0.00025606,0.00177938,0.00127951,0.00080691,-0.00156804,-0.00079260,
 0.00024623,0.00034847,-0.00024926,-0.00255223,0.00381136,0.00180276,0.
 00046287,0.00007807,0.00099395,0.15090058,0.02682231,-0.05186130,0.032
 56801,0.00908814,-0.00190863,0.01245082,-0.01843682,0.00269506,-0.0242
 3592,-0.00139846,0.00081856,0.00020895,-0.00016061,-0.00414641,-0.0023
 0057,0.00025037,-0.00005223,-0.00016593,0.00106531,-0.00211128,-0.0007
 8652,0.00035955,-0.00070056,0.00011009,-0.02809239,0.05847288,-0.12428
 632,0.03090544,-0.20972673,0.00830565,-0.00121239,0.00825173,-0.007700
 00,0.00294440,-0.00931558,-0.00025814,0.00024234,0.00116624,0.00073966
 ,-0.00140796,-0.00049502,-0.00018716,-0.00028438,-0.00022556,0.0018013
 0,-0.00136001,-0.00021430,0.00035733,-0.00021293,-0.00015181,0.1335164
 7,-0.03287945,0.22639249,0.00313806,0.02650307,-0.00084158,-0.05407480
 ,-0.04842230,0.00755839,-0.00421906,0.00151561,-0.00064194,0.00067182,
 0.00110696,0.00073429,-0.00028847,0.00025316,0.00022011,-0.00453165,0.
 00044990,-0.00307482,-0.00734991,-0.02858268,0.00474137,0.00059175,0.0
 0060168,0.00096662,-0.00078332,0.00036166,-0.00030371,0.06557791,-0.00
 222863,-0.01555617,0.00140772,-0.04764490,-0.28667452,0.04159864,0.003
 41249,-0.00006708,0.00030808,-0.00040861,-0.00069424,-0.00055704,0.000
 28137,0.00069506,0.00045032,-0.00188460,0.00183271,-0.00058785,-0.0023
 4052,-0.00893105,0.00128964,0.00013195,0.00014968,0.00016322,0.0005997
 9,-0.00074536,-0.00030659,0.05147296,0.31157318,-0.00026139,-0.0100252
 7,-0.00029689,0.00822441,0.04364634,-0.05649759,0.00166396,-0.00160021
 ,-0.00029524,-0.00021043,-0.00045027,-0.00019298,0.00024761,0.00024512
 ,0.00065126,-0.00291270,0.00017006,-0.00213399,-0.00424220,-0.01886244
 ,0.00225806,0.00015456,0.00019703,0.00180537,0.00006485,-0.00010191,0.
 00002446,-0.01025297,-0.04414435,0.05777688,-0.00842280,-0.00254784,0.
 02467654,-0.05484673,-0.00535743,0.04697197,-0.00152869,-0.00099154,0.
 00001989,0.00036978,0.00066797,0.00015278,-0.00012364,0.00049218,0.000
 04164,0.00146977,0.00068763,0.00051617,0.00565520,0.00165900,-0.028363
 96,-0.00495726,-0.00109232,-0.00260777,0.00129099,-0.00037072,0.000016
 25,-0.00123995,-0.00101905,0.00652542,0.06455633,0.00331341,0.00168480
 ,-0.01725046,-0.00529565,-0.05233475,0.03025725,0.00099974,0.00026271,
 -0.00039194,-0.00015516,-0.00051614,0.00005059,0.00021247,0.00035656,-
 0.00009130,0.00065253,0.00061617,-0.00046113,0.00108740,0.00014560,-0.
 00965497,-0.00192839,-0.00010221,-0.00142272,-0.00068399,0.00124285,0.
 00018066,-0.00525485,-0.00366026,0.03148737,0.00542415,0.05555748,0.00
 124558,0.00149794,-0.00570712,0.04783463,0.02698492,-0.29155838,0.0003
 4908,0.00004913,-0.00002435,-0.00007793,-0.00022255,-0.00002720,0.0000
 3377,0.00055882,0.00012579,0.00052890,0.00149330,-0.00013715,0.0017644
 9,-0.00021152,-0.01836617,-0.00436624,0.00031907,-0.00075453,0.0000727
 3,-0.00006630,0.00163335,0.00118236,0.00195728,-0.00530114,-0.04975654
 ,-0.03146892,0.31845471,-0.00082862,-0.00243122,0.00151078,0.00009440,
 0.00006245,0.00032541,-0.01639500,-0.00186973,-0.01049738,-0.26705626,
 -0.00457289,-0.12111333,0.00274411,0.00517633,-0.00343958,0.00081638,-
 0.00000905,0.00010355,0.00013594,-0.00016053,-0.00017201,-0.00165775,-
 0.00045220,-0.00054476,0.00084613,0.00068441,0.00089324,0.00000757,0.0
 0001558,0.00002394,-0.00000113,0.00004347,0.00004933,0.28460288,-0.000
 98118,0.00033726,0.00274247,-0.00000755,0.00010312,-0.00004638,0.02408
 895,0.00409834,0.01196603,-0.00799279,-0.05452139,-0.01303812,0.002620
 43,-0.00165231,-0.00456402,0.00094811,0.00017609,0.00092821,-0.0001665
 6,0.00031967,0.00009381,0.00000624,0.00021694,0.00014750,0.00022617,0.
 00001338,-0.00028351,-0.00005812,0.00005366,0.00002002,-0.00004330,0.0
 0003341,0.00001276,0.00225402,0.04973139,0.00406958,0.00185022,-0.0038
 5412,-0.00011866,-0.00022849,-0.00020140,-0.00038016,-0.00148868,0.002
 64845,-0.12266871,-0.01109046,-0.09902234,-0.00375462,-0.00409618,0.00
 889581,-0.00185091,0.00007260,-0.00130945,-0.00010162,-0.00000952,0.00
 016755,0.00175005,0.00008760,0.00104462,-0.00070228,0.00016379,-0.0002
 6373,0.00007660,-0.00004258,-0.00001367,0.00003319,-0.00004899,-0.0000
 3150,0.13413583,0.01233068,0.09497570,0.00074499,0.00302918,-0.0040450
 4,0.00003191,0.00037815,0.00000276,0.00788921,0.01743248,0.00860733,-0
 .07017479,-0.05834801,-0.04365564,-0.00064895,-0.00024037,0.00407824,-
 0.00043055,0.00006298,-0.00041969,0.00010334,0.00001366,0.00011495,0.0
 0044377,-0.00010309,0.00007201,-0.00029378,-0.00004267,0.00018447,-0.0
 0013993,0.00002300,0.00005947,-0.00000529,-0.00000938,-0.00000295,-0.0
 0328801,-0.02122394,-0.01093092,0.06557174,0.00607128,0.00067503,-0.00
 192322,-0.00103056,-0.00117691,-0.00028577,-0.00737465,-0.02055419,-0.
 01361291,-0.05489064,-0.24931688,-0.11666483,-0.00313233,-0.00042315,0
 .00134197,-0.00013971,0.00017234,-0.00024899,-0.00037382,0.00015565,-0
 .00002097,0.00030095,0.00011205,0.00039038,-0.00035015,0.00023075,-0.0
 0011076,0.00042579,-0.00029763,-0.00018347,0.00014013,-0.00011888,-0.0
 0007568,0.00118502,0.00192969,0.00087304,0.05821222,0.26727525,-0.0045
 1774,-0.00225115,0.00714235,0.00016664,0.00051826,0.00081385,-0.001889
 07,-0.00022421,0.00324139,-0.04166899,-0.11909756,-0.10047158,0.002862
 07,0.00368048,-0.00521178,0.00095570,-0.00016001,0.00075618,0.00012207
 ,0.00004889,-0.00007599,-0.00079477,-0.00002170,-0.00010543,0.00074644
 ,0.00048670,0.00050820,-0.00001353,0.00011844,0.00002304,-0.00007738,0
 .00009938,0.00001355,-0.00175412,-0.01040014,-0.00363484,0.04581596,0.
 12926214,0.09774125,-0.00399024,0.00153255,-0.00285959,-0.00039181,0.0
 0046780,0.00020940,-0.00494457,-0.02503186,-0.01825089,0.00096079,-0.0
 0163626,0.00057499,-0.05090360,-0.02730619,-0.02013981,0.00350253,0.01
 521124,0.00960401,-0.00280624,0.00355139,0.00168895,-0.00102010,0.0044
 2585,0.00365985,-0.00049076,-0.00143535,-0.00059159,0.00013603,-0.0000
 3547,-0.00004124,0.00003660,-0.00004149,-0.00002030,0.00024191,0.00011
 885,0.00041749,0.00010628,0.00096156,0.00019289,0.05754332,0.00040839,
 0.00150304,-0.00042908,0.00037744,0.00044976,0.00045369,-0.00052078,-0
 .00075248,-0.00023950,0.00083806,0.00065559,0.00119670,-0.03069898,-0.
 21287635,-0.12055333,0.00138826,-0.00124810,0.00103387,0.00364320,-0.0
 0383627,-0.00063432,-0.00397425,-0.01179896,-0.01461281,-0.00013512,-0
 .00013527,-0.00009906,0.00003043,-0.00000450,0.00011351,-0.00007154,0.
 00005330,-0.00008554,-0.00020649,0.00014129,0.00035100,-0.00011394,0.0
 0070992,-0.00038410,0.02795776,0.22649968,-0.00190564,0.00094934,0.000
 63503,0.00006637,0.00032868,0.00042972,-0.00033876,-0.01168671,-0.0070
 7509,0.00076631,0.00020881,0.00027108,-0.02291726,-0.11997638,-0.14338
 891,-0.00586763,-0.01416811,-0.00878052,0.00217531,0.00035631,-0.00150
 635,0.00406490,0.00916649,0.01046480,-0.00018301,-0.00031050,-0.000067
 18,-0.00008142,-0.00003133,-0.00001585,0.00011809,-0.00002328,0.000059
 78,0.00013272,0.00029252,0.00019496,-0.00027665,0.00073458,0.00013734,
 0.02511379,0.13523651,0.14685341,-0.00033334,-0.00001237,0.00047533,0.
 00026748,-0.00027736,0.00068130,0.00016167,-0.00005715,0.00292783,0.00
 004661,-0.00020431,-0.00005703,0.00387127,-0.00854998,0.01664141,-0.08
 140760,0.00793640,-0.01421956,-0.00018355,-0.00154657,0.00425776,-0.00
 307716,-0.00228459,0.00288689,-0.00034246,-0.00018015,-0.00004987,-0.0
 0010759,0.00018315,-0.00042624,0.00048971,-0.00062357,-0.00031854,-0.0
 0012255,0.00000145,0.00000613,0.00002356,-0.00010951,-0.00007868,-0.00
 063359,-0.00004847,0.00078518,0.58131485,0.00001214,-0.00057323,-0.000
 10849,0.00080968,-0.00046068,0.00049609,-0.00074096,0.00021525,-0.0002
 9841,0.00032552,0.00059414,-0.00047298,-0.00527179,0.00261654,-0.00610
 337,0.00937281,-0.09794081,0.03532548,0.00404203,-0.00986558,0.0260915
 3,-0.00171242,-0.00316020,0.00143175,-0.00005484,0.00010462,0.00001087
 ,0.00045125,0.00021679,0.00072341,-0.00074591,-0.00076822,0.00076276,-
 0.00006271,-0.00010155,0.00006199,0.00000325,-0.00005188,-0.00012970,0
 .00081942,0.00017626,-0.00133687,0.00715136,0.53863736,0.00046711,-0.0
 0009264,-0.00051346,0.00003944,-0.00024106,0.00052661,0.00005697,0.000
 33076,-0.00103930,-0.00024156,0.00040307,-0.00064084,0.00085322,0.0077
 0952,-0.01805447,-0.01731713,0.03350632,-0.16289313,0.00402762,0.00487
 966,-0.00038639,0.00232293,0.00109938,-0.00184030,-0.00029572,-0.00005
 787,0.00001991,-0.00058224,-0.00020109,-0.00010661,0.00009714,-0.00015
 688,0.00028303,0.00010934,0.00012374,-0.00026476,-0.00011822,-0.000042
 43,0.00018294,-0.00022561,0.00003032,-0.00012187,0.00275455,0.03977707
 ,0.48031697,-0.00014884,0.00026542,-0.00013942,0.00063341,0.00109887,0
 .00021984,-0.00075091,-0.00038426,0.00337088,-0.00044960,-0.00001818,-
 0.00026962,-0.02880302,-0.00584831,-0.00175278,-0.15717121,-0.02082971
 ,-0.03433084,-0.00630793,-0.00654616,0.00055715,-0.00124794,-0.0011969
 2,0.00240331,0.00006489,-0.00010007,0.00000340,0.00037327,0.00024446,0
 .00017125,0.00004256,-0.00009882,0.00008796,0.00009463,0.00020374,-0.0
 0027265,-0.00009327,-0.00005107,0.00016675,0.00210866,-0.00012392,-0.0
 0208048,-0.01086761,0.00016737,-0.01020719,0.46938130,0.00044939,-0.00
 040165,-0.00016112,-0.00115736,-0.00593464,0.00334207,0.00107405,-0.00
 029422,-0.00287551,0.00070851,0.00008442,0.00063141,0.01191124,0.00234
 066,0.00287654,-0.02313292,-0.07862988,-0.00532135,-0.03292565,-0.0115
 8107,-0.01100778,-0.00081604,-0.00175551,0.00045916,-0.00015359,0.0001
 0426,0.00010426,-0.00178116,-0.00068785,-0.00105927,0.00039721,0.00013
 273,-0.00000774,-0.00006204,-0.00027397,0.00034993,0.00011202,0.000067
 70,-0.00019878,0.00043416,0.00086183,0.00037774,0.01211575,0.00329852,
 0.00582316,-0.02567344,0.55694526,0.00003889,-0.00036924,0.00007602,0.
 00013616,-0.00009071,-0.00045238,0.00129983,0.00069329,-0.00488995,0.0
 0096502,-0.00024382,0.00092613,0.02080392,0.00503888,0.00710527,-0.029
 23844,-0.00359366,-0.08812688,-0.00217985,-0.00363140,0.00010352,0.001
 27050,-0.00010371,0.00023619,0.00015251,0.00009397,0.00015315,-0.00008
 836,0.00000607,0.00014352,-0.00006792,0.00018589,0.00015133,-0.0000514
 6,-0.00035682,0.00052552,0.00012996,0.00007769,-0.00033455,-0.00011462
 ,-0.00011610,0.00123533,-0.03397381,-0.00434532,-0.01826168,-0.0233741
 7,-0.01656377,0.56960583,-0.00210762,-0.00212726,-0.00425518,-0.019753
 26,0.01612704,0.00403632,0.00062805,-0.00088406,-0.00022654,0.00011297
 ,0.00016899,0.00009128,0.00100692,0.00023688,0.00017832,0.00646280,-0.
 00517035,-0.00041869,-0.19560324,0.12377711,0.02486904,-0.00329256,0.0
 0164999,-0.00170785,-0.00126630,0.00072361,0.00052263,0.00079197,-0.00
 040969,0.00074012,0.00050676,0.00009260,-0.00060398,-0.00000440,-0.000
 07668,0.00000488,0.00000460,0.00006889,0.00002575,0.00003106,0.0000056
 6,-0.00052608,-0.00008929,-0.00010705,-0.00038387,0.00129007,-0.000055
 80,-0.00027744,0.21052021,-0.00173540,0.00023914,-0.00156720,-0.009094
 38,0.00644346,0.00153720,-0.00101483,0.00002686,-0.00040960,0.00024106
 ,0.00002472,0.00014216,-0.00045444,-0.00570154,-0.00263508,0.02007231,
 -0.01269432,-0.00442296,0.12563807,-0.15410264,-0.01670721,-0.00058387
 ,-0.00208469,-0.00089206,-0.00057258,0.00039097,0.00014312,0.00045064,
 0.00111859,0.00050249,0.00053835,0.00008047,0.00017057,0.00006167,-0.0
 0002829,0.00009830,0.00000817,0.00010713,-0.00001038,0.00154413,-0.000
 69462,-0.00092745,0.00005796,-0.00116648,-0.00132631,0.00162850,0.0023
 3976,0.00056145,-0.13511414,0.16557774,-0.00195594,-0.00148905,-0.0016
 2447,-0.01386482,0.01182196,0.00320388,-0.00040768,-0.00035303,-0.0002
 7020,0.00015539,0.00012544,0.00014548,0.00081078,-0.00301568,-0.003268
 70,-0.00655918,0.00170886,-0.00103550,0.02495536,-0.01636987,-0.054672
 68,0.01943265,-0.01632133,0.00198075,-0.00066543,0.00035986,0.00028272
 ,0.00071671,-0.00010832,0.00074548,0.00081217,0.00031683,0.00021662,0.
 00010930,-0.00000006,0.00000311,-0.00002363,0.00008900,0.00002574,0.00
 051780,-0.00149239,0.00076272,-0.00026170,0.00070167,0.00051426,-0.000
 34033,-0.00087967,0.00058688,-0.02326889,0.02480934,0.05229360,-0.0001
 2319,-0.00011866,0.00021735,-0.00043904,-0.00007483,0.00208376,0.00054
 978,0.00211329,-0.00042091,-0.00037869,-0.00020234,-0.00042417,-0.0070
 9310,-0.00040690,-0.00493280,-0.00028608,0.00043011,0.00008437,0.00897
 044,-0.00045251,0.00688006,-0.20962085,-0.00637371,-0.13483084,0.00012
 313,0.00010215,-0.00013792,-0.00003614,0.00003822,0.00000530,0.0005042
 6,0.00021673,0.00039211,-0.00018635,0.00004750,0.00018651,0.00003280,0
 .00007327,-0.00005394,0.00062654,-0.00006384,0.00031349,0.00002200,-0.
 00000533,-0.00015217,-0.00174636,-0.00114283,0.00062377,0.00090015,0.0
 0016212,-0.00097018,0.22712932,-0.00007562,-0.00028719,-0.00017394,0.0
 0138735,0.00010140,-0.00317877,-0.00194242,-0.00596484,0.00251197,0.00
 165496,0.00037893,0.00066687,0.02483889,0.00151683,0.02065132,0.000709
 24,-0.00034806,-0.00079394,-0.01158571,-0.00112845,-0.00850842,-0.0074
 2750,-0.04334509,-0.00150126,0.00003343,0.00010539,-0.00008373,0.00000
 108,0.00006622,0.00015537,-0.00081663,-0.00021286,-0.00075120,0.000577
 56,-0.00008025,-0.00054129,-0.00013095,-0.00011703,0.00023087,-0.00005
 355,0.00169355,-0.00145262,-0.00024813,0.00007573,-0.00004301,-0.00054
 978,-0.00047599,0.00082450,-0.00021487,0.00044771,0.00103314,0.0078230
 0,0.04773168,0.00107349,0.00013795,0.00021535,0.00320659,0.00083967,-0
 .00486914,0.00090673,0.00056098,-0.00003160,-0.00015975,-0.00003754,-0
 .00014045,-0.00320397,-0.00090862,-0.00275724,-0.00069993,-0.00100608,
 -0.00008047,-0.02205108,-0.00024368,-0.01566439,-0.13245962,-0.0003165
 7,-0.15661148,-0.00011583,-0.00003757,0.00013413,0.00007875,-0.0001128
 4,0.00007746,-0.00149254,-0.00058842,-0.00102588,-0.00006755,-0.000000
 79,0.00009647,0.00004062,0.00005197,-0.00003942,0.00003890,0.00038007,
 0.00064536,0.00034400,0.00022294,0.00011056,-0.00054780,0.00035789,-0.
 00093063,0.00005940,-0.00053226,0.00190194,0.14390316,0.00157937,0.168
 03531,-0.00069245,0.00003494,-0.00071941,0.00009621,0.00010777,-0.0010
 6405,0.00061209,-0.00044185,-0.00018637,0.00023289,0.00010224,0.000215
 83,0.00791918,0.00432851,-0.00352114,-0.00018753,0.00090567,0.00040467
 ,-0.00491800,-0.00322720,-0.00031436,-0.20099770,-0.10400562,0.0782453
 5,0.00013847,0.00006477,-0.00004393,0.00023965,0.00018237,0.00038500,-
 0.00000985,0.00009397,0.00001702,0.00007436,-0.00004030,0.00000936,-0.
 00000877,-0.00002172,0.00000815,-0.00005657,0.00027188,0.00004370,0.00
 023964,-0.00032715,-0.00073376,-0.00000420,0.00005580,-0.00021418,-0.0
 0038649,-0.00020607,0.00089323,-0.01801832,-0.01270911,0.00964867,0.21
 526722,-0.00045381,-0.00006671,0.00022244,-0.00032612,0.00109790,0.001
 13107,-0.00176164,0.00155436,-0.00169098,0.00042916,-0.00011939,-0.000
 18378,-0.02039961,-0.00902767,0.00727325,0.00071271,-0.00296996,0.0023
 1400,0.00988090,0.00565969,-0.00060330,-0.10257971,-0.12061307,0.05100
 908,0.00016968,0.00013848,-0.00018593,0.00018440,-0.00014593,0.0002843
 5,0.00020963,-0.00005093,0.00011090,-0.00002244,-0.00004813,0.00014154
 ,-0.00006823,0.00004329,0.00001169,-0.00023061,-0.00157552,0.00106751,
 -0.00120903,0.00109837,0.00045657,0.00038665,0.00024065,0.00005441,0.0
 0045462,-0.00008660,-0.00085706,-0.00040625,0.00014136,-0.00026020,0.1
 1471080,0.12395045,-0.00027239,0.00040387,-0.00059395,0.00094883,0.000
 25014,0.00185571,0.00062005,0.00088249,0.00085184,-0.00035087,-0.00012
 148,-0.00014403,0.00314476,0.00243471,-0.00462406,0.00043443,0.0020469
 2,-0.00652699,0.01719723,0.01478128,-0.00640476,0.07646583,0.05058319,
 -0.08716135,-0.00009984,-0.00019782,0.00031511,-0.00035468,-0.00056425
 ,-0.00023020,0.00009934,-0.00008825,0.00044095,0.00001002,0.00006703,-
 0.00009190,0.00000399,-0.00007473,-0.00001792,0.00001108,-0.00012446,-
 0.00004237,0.00112648,0.00126214,0.00032945,-0.00088122,-0.00017967,-0
 .00019486,0.00056415,0.00013825,-0.00128250,-0.01516810,-0.01105400,0.
 00913260,-0.08258059,-0.06043965,0.09446474,0.00011497,-0.00050355,0.0
 0065395,0.00008086,-0.00135581,-0.00053568,-0.00095552,-0.00015027,0.0
 0145235,-0.00024887,-0.00029248,0.00091903,-0.00020042,0.00026208,0.00
 009311,-0.00303464,0.00013403,-0.00140308,-0.00040801,-0.00048731,-0.0
 0034802,0.00015059,0.00010286,-0.00002388,-0.00008769,-0.00001813,-0.0
 0012263,0.00003605,-0.00004776,0.00058626,-0.00012542,-0.00018874,0.00
 098967,-0.00000998,-0.00004241,0.00003281,0.00005471,0.00004072,-0.000
 13319,0.00000147,0.00002062,-0.00004974,-0.27273852,-0.04024832,-0.089
 28208,0.00063577,0.00106300,-0.00142397,0.00001492,0.00000386,0.000027
 64,-0.00000901,0.00000491,0.00009885,0.00010891,0.00008043,-0.00009800
 ,0.29858398,-0.00046250,-0.00003711,0.00044371,-0.00022423,-0.00155149
 ,0.00094438,-0.00073204,0.00092955,0.00061283,-0.00000054,-0.00071722,
 0.00033720,-0.00025413,0.00027845,-0.00056363,0.01358436,0.00176953,0.
 00311693,0.00047114,0.00037595,-0.00057783,0.00001876,0.00038103,-0.00
 020647,-0.00018970,-0.00000678,-0.00006519,0.00010332,0.00010384,-0.00
 014280,-0.00021070,-0.00166571,0.00014983,0.00005375,0.00005390,-0.000
 05549,0.00002783,-0.00002986,-0.00008183,-0.00002854,-0.00001027,-0.00
 001483,-0.04117640,-0.05322209,-0.01532629,0.00006137,-0.00111063,0.00
 211333,-0.00006456,0.00000472,-0.00007106,0.00002298,-0.00006640,-0.00
 011343,-0.00001144,0.00001184,-0.00005140,0.04689150,0.05705863,0.0007
 1864,0.00051073,-0.00007741,-0.00006355,0.00070578,0.00010170,0.000452
 06,0.00022166,-0.00156504,0.00043419,-0.00031368,0.00038952,-0.0004796
 8,-0.00053118,0.00108320,-0.02768978,-0.00706206,-0.00923283,-0.000174
 84,-0.00074309,0.00063798,-0.00026501,-0.00019078,0.00055753,0.0002021
 6,0.00012721,0.00004099,0.00012220,-0.00014974,0.00017376,0.00012930,0
 .00010746,0.00031400,0.00005833,-0.00000203,-0.00002357,-0.00003495,0.
 00003987,0.00001768,0.00008073,-0.00003101,0.00006915,-0.08636346,-0.0
 1442646,-0.08153104,0.00037574,0.00311597,-0.00569865,0.00005975,0.000
 02827,0.00007304,0.00003597,-0.00011691,0.00015513,0.00013189,0.000022
 57,0.00000241,0.09618593,0.01481078,0.08806218,0.00014655,-0.00005242,
 -0.00006237,0.00008609,-0.00035180,-0.00015779,0.00034957,-0.00052974,
 -0.00054610,-0.00000470,0.00053184,-0.00023101,0.00027402,-0.00031572,
 -0.00022510,-0.00093884,0.00417628,0.00055128,-0.00003815,-0.00046755,
 -0.00099765,0.00026685,0.00013405,-0.00006091,0.00011881,0.00005329,0.
 00003276,0.00001529,-0.00004699,0.00026001,-0.00022186,0.00021523,0.00
 039330,0.00001451,0.00000262,0.00001112,-0.00004732,0.00002779,0.00015
 661,0.00008049,0.00003974,0.00001441,-0.05121382,-0.03544464,-0.002126
 16,0.00021035,0.00103421,-0.00011735,-0.00003643,-0.00010095,0.0001904
 0,-0.00003957,0.00005125,0.00001250,0.00005098,-0.00002751,-0.00009615
 ,-0.00365335,-0.03025230,-0.00146117,0.05144263,0.00019568,0.00002709,
 -0.00008604,0.00053976,0.00031644,-0.00002103,-0.00005646,-0.00012967,
 0.00004205,-0.00012842,0.00014475,-0.00008364,0.00007195,0.00025094,0.
 00038578,-0.00194674,-0.01586779,0.00013699,0.00090116,0.00190535,0.00
 141288,-0.00038755,-0.00034356,0.00023580,-0.00002068,0.00005661,0.000
 00433,-0.00007646,-0.00003650,0.00002832,0.00008296,0.00015935,0.00016
 344,-0.00000406,0.00002503,-0.00000081,-0.00003651,0.00006533,0.000114
 95,-0.00033968,0.00009777,0.00037597,-0.03502779,-0.29788407,-0.015013
 77,-0.00074280,0.00034744,-0.00115885,-0.00003204,-0.00035909,0.000123
 64,0.00000006,0.00004758,0.00011670,-0.00003140,0.00006709,0.00035291,
 -0.00089353,-0.00499969,-0.00077404,0.03901494,0.32608442,0.00001189,0
 .00002834,0.00005267,-0.00052787,-0.00071875,-0.00066090,0.00006825,-0
 .00016309,-0.00008394,0.00006250,0.00002591,0.00008372,0.00045300,-0.0
 0037738,0.00089765,0.00324285,0.03274312,0.00136052,-0.00196561,0.0005
 3795,-0.00449055,0.00029128,0.00076079,-0.00003799,0.00009621,-0.00002
 612,-0.00003223,0.00005843,-0.00000961,0.00023914,-0.00005199,-0.00003
 917,0.00053857,-0.00000434,-0.00003335,0.00000749,0.00002723,-0.000003
 26,-0.00003111,0.00003778,-0.00020470,-0.00017398,-0.00211453,-0.01526
 005,-0.04623118,0.00094659,0.00085613,0.00109509,0.00018712,0.00067255
 ,-0.00034902,-0.00001260,-0.00002371,-0.00003390,0.00020992,-0.0002439
 0,-0.00043965,-0.00074941,-0.01108522,-0.00134779,0.00402561,0.0140947
 6,0.05114852,0.00005540,0.00022659,-0.00006141,-0.00010926,0.00024368,
 0.00049686,-0.00015078,0.00029280,0.00035342,0.00009034,-0.00051155,0.
 00032368,0.00020853,0.00035209,-0.00134668,0.00153903,-0.00276189,-0.0
 0231654,0.00034708,0.00017458,0.00042545,0.00004175,-0.00004897,0.0000
 3528,0.00010304,0.00005200,0.00000767,0.00002966,-0.00006653,-0.000130
 16,-0.00017219,-0.00010249,-0.00034244,0.00000239,0.00001559,-0.000022
 41,0.00002186,0.00000878,-0.00003256,-0.00001524,-0.00004841,0.0001244
 2,-0.16131783,0.06421345,0.10929857,0.00055820,-0.00019649,-0.00083927
 ,-0.00002708,-0.00021443,0.00010368,0.00002609,-0.00009399,-0.00001255
 ,0.00003343,0.00004070,0.00007159,-0.01857563,0.01180991,0.01933630,0.
 00316473,-0.00156212,-0.00406930,0.17371131,-0.00003103,0.00003845,0.0
 0007149,-0.00012155,0.00018474,0.00001592,0.00053486,-0.00018443,-0.00
 009905,-0.00006780,0.00016443,-0.00018576,0.00042732,-0.00033180,0.002
 78117,-0.01001553,0.00534886,0.00967885,-0.00043512,0.00062516,-0.0007
 7286,-0.00013188,0.00028018,0.00017743,0.00003386,-0.00002310,0.000018
 22,0.00004613,-0.00000309,-0.00011354,-0.00021226,-0.00013707,-0.00006
 620,0.00000036,0.00002545,0.00000761,-0.00003510,0.00001475,0.00010240
 ,-0.00025414,-0.00013119,0.00042075,0.06386945,-0.08195562,-0.06204207
 ,-0.00036164,0.00007849,-0.00028626,0.00020536,0.00008746,-0.00007792,
 0.00000090,-0.00001043,-0.00003414,0.00003043,-0.00019593,-0.00006392,
 -0.00398171,0.00151751,0.00473674,0.02229904,-0.01133883,-0.02067642,-
 0.07170101,0.08579112,-0.00001582,-0.00012937,0.00007081,-0.00000246,0
 .00034854,-0.00000824,-0.00158414,0.00010052,-0.00014191,0.00016367,-0
 .00027224,0.00039910,-0.00272892,0.00220823,-0.00256186,0.02124449,-0.
 01276213,-0.02160115,0.00001730,0.00021880,0.00080570,0.00072449,0.000
 16234,-0.00042447,0.00005883,0.00006740,0.00005194,0.00003296,0.000001
 46,0.00006048,0.00028892,0.00014323,0.00007089,0.00006519,-0.00003297,
 0.00002624,-0.00000021,0.00003585,-0.00004665,0.00038889,0.00000851,-0
 .00052707,0.10913153,-0.06218796,-0.15145456,0.00161663,-0.00055222,0.
 00077352,-0.00004131,0.00051022,-0.00003952,-0.00006196,0.00006409,-0.
 00003543,-0.00017079,0.00057840,-0.00013766,-0.00708900,0.00517924,0.0
 0806318,0.00057968,-0.00093552,-0.00146867,-0.12119461,0.06663582,0.16
 749585,0.00011036,0.00001594,0.00003768,0.00000901,0.00007455,-0.00008
 338,0.00002714,0.00008272,-0.00007246,0.00010748,-0.00004458,0.0001008
 6,0.00122206,0.00053121,-0.00038900,-0.00397355,0.01303015,-0.02667166
 ,0.00127732,0.00057259,0.00000908,-0.00133855,-0.00055420,-0.00036591,
 0.00006121,0.00001459,0.00004019,-0.00000122,-0.00001234,0.00003625,0.
 00005976,0.00009211,0.00014913,0.00005545,-0.00000858,-0.00002545,-0.0
 0000505,-0.00000178,-0.00001813,-0.00019541,0.00020585,0.00034978,-0.0
 0595918,-0.00203686,-0.00110059,-0.05707199,0.01892329,-0.04468772,0.0
 0006163,-0.00031165,0.00017949,-0.00116339,-0.00140122,0.00132605,0.00
 041919,0.00003289,0.00034392,-0.00019092,0.00060307,-0.00201487,-0.000
 01847,-0.00007237,0.00035095,0.00018558,-0.00023045,-0.00015958,0.0622
 0261,-0.00007127,0.00002518,-0.00001425,0.00009318,0.00007707,-0.00002
 771,0.00006317,-0.00014518,-0.00016763,0.00002818,0.00001344,0.0000073
 7,0.00036447,0.00017259,0.00071889,-0.00028138,0.00180553,-0.00794682,
 0.00020786,0.00043720,-0.00039760,-0.00134958,-0.00029375,0.00042237,0
 .00001236,-0.00003320,-0.00000015,0.00003570,0.00001750,0.00000996,0.0
 0002290,0.00000953,0.00001209,-0.00000093,-0.00001241,0.00000738,-0.00
 000421,-0.00001302,0.00001039,0.00017345,-0.00024378,0.00004328,-0.001
 05051,-0.00011162,-0.00037372,0.02031377,-0.08656057,0.09201991,0.0001
 0449,-0.00017022,-0.00012776,-0.00177745,-0.00034806,0.00047066,0.0000
 4537,-0.00000858,-0.00009860,-0.00027609,0.00068005,-0.00019135,-0.000
 10940,0.00055597,-0.00025439,-0.00015096,-0.00006644,0.00031025,-0.019
 08962,0.09116445,0.00015726,0.00003553,0.00011596,0.00013116,-0.000249
 39,-0.00007118,-0.00004239,0.00009730,0.00015608,-0.00003293,-0.000069
 75,0.00005237,0.00026014,0.00002412,-0.00007792,-0.00080582,0.00332962
 ,-0.00933904,0.00004149,0.00071848,-0.00043933,0.00111906,0.00106866,-
 0.00068224,0.00006110,0.00000739,-0.00000403,-0.00007425,-0.00006494,0
 .00000123,0.00004411,0.00008485,0.00010171,0.00002570,0.00002221,-0.00
 004763,0.00000133,-0.00000177,-0.00000319,-0.00016033,0.00001332,0.000
 17218,-0.00327103,-0.00128679,0.00013591,-0.04742487,0.09087268,-0.261
 43557,0.00001512,-0.00042931,-0.00014227,0.00204119,0.00079528,0.00075
 384,0.00030723,-0.00010169,0.00039747,-0.00014604,0.00053878,-0.000653
 99,0.00020671,0.00003662,0.00017390,0.00010465,-0.00002033,0.00053525,
 0.05035924,-0.10294916,0.28581603,0.00001238,0.00023692,0.00001540,0.0
 0015409,-0.00000416,-0.00008554,-0.00025090,-0.00004737,0.00214644,-0.
 00052638,-0.00001820,-0.00045025,-0.00498491,-0.00130422,-0.00424534,-
 0.02371445,0.00975828,0.02031040,0.00144383,0.00142644,0.00032506,0.00
 036242,0.00052462,-0.00042364,-0.00002701,-0.00006278,-0.00007536,0.00
 002722,-0.00001456,-0.00002591,-0.00004456,-0.00003361,-0.00009195,0.0
 0000435,0.00017611,-0.00024382,-0.00005039,-0.00004881,0.00015320,0.00
 025487,0.00006874,-0.00021412,0.00096445,0.00013338,0.00158413,-0.1628
 6719,0.06074084,0.11214466,0.00034919,-0.00101931,0.00001567,0.0000360
 3,-0.00010827,0.00005465,0.00009023,-0.00012600,-0.00003282,0.00044713
 ,-0.00032481,-0.00009068,-0.00004327,0.00000282,-0.00010321,0.00023395
 ,-0.00003976,-0.00114786,0.00449125,-0.00314913,-0.00385544,0.18148033
 ,0.00003943,0.00005503,0.00012651,0.00012415,0.00004385,-0.00013842,-0
 .00024262,0.00016041,0.00045253,-0.00012177,-0.00004854,-0.00008268,-0
 .00175113,-0.00014178,-0.00020612,-0.00573739,0.00165117,0.00521790,-0
 .00002485,0.00168600,0.00054630,-0.00009443,0.00007078,0.00043201,0.00
 004785,-0.00000628,-0.00001416,0.00004689,0.00001364,0.00002772,-0.000
 00661,-0.00000142,0.00000340,0.00002459,0.00005430,-0.00004530,-0.0000
 2460,0.00000587,0.00003434,-0.00016654,0.00009726,0.00016436,0.0002233
 0,-0.00005447,0.00012949,0.06107765,-0.07816683,-0.05768948,0.00043284
 ,-0.00012527,-0.00011145,-0.00017530,-0.00001260,-0.00016937,-0.000124
 83,0.00008071,-0.00013469,-0.00011000,-0.00008698,0.00021461,0.0001322
 5,-0.00008008,-0.00016744,0.00016720,0.00025082,0.00021574,-0.00976354
 ,0.00459085,0.00814886,-0.06617541,0.08065186,0.00002673,0.00000217,0.
 00004550,-0.00006043,0.00027940,0.00001499,-0.00034481,0.00010021,0.00
 047302,-0.00010350,0.00003979,-0.00001167,-0.00222507,-0.00040033,0.00
 011179,-0.00683549,0.00405116,0.00562688,0.00055740,0.00029747,0.00025
 262,-0.00003450,0.00021014,-0.00046287,0.00000053,0.00000835,0.0000273
 5,0.00007874,0.00003931,0.00001321,0.00002191,-0.00001829,0.00002733,0
 .00004920,0.00004240,-0.00006446,-0.00003127,-0.00000327,0.00003606,-0
 .00017564,0.00013348,-0.00002345,-0.00078877,0.00018745,0.00072684,0.1
 1285952,-0.05812764,-0.15456860,0.00024880,0.00033915,0.00000402,0.000
 26029,-0.00024567,0.00031883,0.00017139,0.00000949,0.00013241,0.000153
 05,0.00004744,0.00024918,0.00002464,0.00004883,-0.00005997,-0.00027841
 ,-0.00014387,0.00009075,0.01950699,-0.01111316,-0.01831785,-0.12304512
 ,0.06456025,0.16657158,0.00029146,-0.00015104,-0.00000651,-0.00018520,
 -0.00192205,0.00091047,0.00015502,0.00012854,-0.00021597,0.00005149,0.
 00006287,0.00000826,0.00247512,-0.00057010,-0.00079070,-0.00523078,-0.
 03164244,-0.00119032,-0.00534701,0.00004926,-0.00324894,0.00033409,-0.
 00001894,-0.00034579,-0.00004900,0.00006664,0.00002198,-0.00063799,-0.
 00022879,-0.00034430,0.00007938,0.00004808,-0.00002183,0.00000453,-0.0
 0001021,0.00003575,-0.00001955,0.00004012,0.00001802,-0.00005875,0.000
 64582,0.00064155,0.00089825,-0.00082454,0.00117301,-0.04792607,-0.0219
 1535,-0.00087624,0.00010710,-0.00001504,-0.00013430,-0.00009132,0.0000
 4020,0.00013581,-0.00002041,0.00007952,0.00001408,0.00010592,0.0002024
 6,0.00037564,0.00004660,0.00058673,-0.00043898,-0.00002413,0.00017047,
 -0.00006728,-0.00033529,0.00583794,0.00097429,0.00211788,0.02219923,-0
 .00001525,0.05325970,0.00008242,0.00001464,-0.00007550,0.00015280,-0.0
 0045214,0.00071375,-0.00000544,0.00011616,0.00012516,-0.00009741,0.000
 04426,-0.00007817,0.00032309,0.00040953,0.00008221,-0.00190013,-0.0096
 2992,0.00013835,-0.00158784,0.00158061,-0.00166244,0.00023596,0.000133
 74,-0.00011733,-0.00008044,0.00005520,0.00000454,-0.00023120,-0.000048
 27,-0.00016941,0.00001083,0.00003159,-0.00011144,-0.00000755,0.0000235
 1,-0.00000741,-0.00002125,0.00003555,0.00003489,-0.00059114,0.00019831
 ,0.00053849,0.00085944,0.00031175,0.00062982,-0.02298646,-0.30096246,-
 0.01307433,0.00014367,0.00035120,0.00005304,-0.00003348,-0.00001883,-0
 .00018403,-0.00010247,0.00007437,0.00003741,-0.00003390,0.00044587,0.0
 0003240,-0.00001051,0.00079633,-0.00042156,-0.00003831,-0.00005294,0.0
 0004894,-0.00062183,-0.01153690,-0.00059692,-0.00057452,-0.01070168,-0
 .00035531,0.02711747,0.32874658,0.00001220,0.00001471,-0.00003036,-0.0
 0010385,-0.00056528,0.00034222,0.00009253,-0.00016171,-0.00010832,0.00
 000842,0.00005777,-0.00001900,0.00022034,0.00078746,0.00063771,-0.0008
 3482,-0.01053405,-0.00169397,-0.00172038,0.00026567,-0.00088520,-0.000
 02738,0.00047767,-0.00059780,-0.00003787,-0.00002023,0.00000271,-0.000
 19483,-0.00009447,-0.00009117,0.00005612,-0.00001230,0.00001740,-0.000
 00624,-0.00001205,-0.00000325,0.00000118,-0.00000510,0.00001421,0.0000
 0532,-0.00008362,0.00005335,0.00012014,-0.00107607,0.00029444,-0.00120
 079,-0.01224234,-0.04782363,0.00001949,0.00014523,-0.00013939,0.000224
 80,0.00003174,0.00041734,0.00014914,0.00004262,0.00024220,0.00019545,0
 .00022345,0.00010355,-0.00045885,0.00032864,-0.00019261,-0.00004223,-0
 .00008809,-0.00004052,0.00277640,0.02963165,0.00279138,-0.00261572,-0.
 02150453,-0.00120776,0.00337731,0.01438892,0.04791627,-0.11479464,-0.0
 7181240,0.08787172,-0.01586558,-0.01078832,0.01915391,-0.00425451,-0.0
 0610024,0.00454980,0.00029558,0.00109894,-0.00004164,0.00067165,-0.000
 57701,-0.00058296,0.00055161,0.00040829,0.00018028,-0.00027707,0.00102
 704,0.00145397,-0.00066884,-0.00065489,0.00019736,0.01098811,0.0105893
 7,-0.01268637,0.00177377,-0.00019690,-0.00030089,-0.00336172,0.0019242
 6,0.00051264,-0.00018948,-0.00005815,0.00030290,0.00017687,-0.00003177
 ,-0.00035816,-0.00012368,0.00010390,-0.00026925,0.00009461,0.00008086,
 -0.00001776,0.00006303,-0.00000680,-0.00004042,-0.00022175,0.00003023,
 -0.00046820,0.00031088,0.00023589,-0.00011756,-0.00022215,0.00023885,-
 0.00112112,-0.00009727,0.00008143,-0.00006085,-0.00001170,-0.00003743,
 -0.00003176,0.00003979,0.00000079,-0.00004864,-0.00003703,0.00000769,-
 0.00003670,0.00003945,0.00000365,-0.00002095,-0.00000104,-0.00000179,-
 0.00001589,0.12512109,-0.07442911,-0.11264777,0.09483078,0.01240093,0.
 00623290,-0.01342910,-0.01464248,-0.02299176,0.01639250,-0.00140203,-0
 .00008011,-0.00223731,0.00087294,-0.00131860,0.00003441,0.00036554,-0.
 00003782,0.00001497,0.00003610,-0.00026511,-0.00077685,-0.00039499,0.0
 0013023,0.00079367,-0.00228773,-0.00269860,0.00394800,0.00036614,0.001
 71157,-0.00075815,0.00315293,-0.00079807,-0.00117913,-0.00027741,-0.00
 061812,0.00125952,0.00109931,0.00049914,-0.00179425,-0.00004735,0.0001
 6978,-0.00033327,0.00020761,-0.00002884,0.00001826,0.00006372,-0.00000
 647,-0.00004593,0.00006479,-0.00002616,0.00013186,0.00020308,0.0001097
 0,-0.00017264,0.00031466,0.00074987,-0.00004738,0.00002599,-0.00010665
 ,-0.00014173,-0.00000299,0.00009179,-0.00001142,-0.00010022,0.00002343
 ,0.00003483,-0.00002993,-0.00000561,-0.00002365,-0.00001722,0.00001336
 ,0.00001104,0.00002316,0.00003397,0.00000429,0.07443455,0.13186396,0.0
 8678275,0.08983331,-0.15865737,0.00514466,0.00265364,-0.00696364,-0.00
 801918,-0.00838783,0.01088490,-0.00027670,-0.00085981,0.00060454,0.000
 52471,-0.00015332,-0.00062727,0.00027205,-0.00005749,-0.00009233,-0.00
 010050,-0.00024527,-0.00021682,-0.00059582,0.00053139,-0.00094865,0.01
 337898,0.01453418,-0.01850831,-0.00006321,-0.00036519,0.00118199,0.001
 79714,-0.00119647,0.00048441,0.00004886,-0.00001915,0.00024070,0.00039
 967,0.00036066,-0.00068133,0.00003773,0.00013903,-0.00026157,-0.000215
 32,-0.00002270,-0.00010133,0.00004314,0.00000993,0.00000007,0.00008765
 ,0.00006151,0.00008400,-0.00008653,-0.00007605,0.00022572,-0.00129197,
 -0.00016339,-0.00027269,0.00001660,-0.00016243,0.00003613,0.00008159,0
 .00007109,0.00003624,0.00000699,0.00002402,0.00004401,0.00002276,-0.00
 000189,0.00001092,-0.00000282,-0.00001037,-0.00000572,0.00001022,0.000
 02594,0.00000021,-0.09800346,-0.09652333,0.17350320\\-0.00002516,-0.00
 001792,0.00001238,0.00002389,0.00000342,-0.00000874,0.00003751,0.00004
 999,-0.00000312,0.00000454,-0.00000231,0.00000247,-0.00001291,0.000005
 66,0.00001385,0.00002486,0.00000414,-0.00003631,-0.00003149,0.00001225
 ,-0.00000847,0.00001317,-0.00004646,-0.00000443,-0.00000223,-0.0000020
 0,-0.00000313,0.00000071,0.00000160,0.00000181,0.00000055,-0.00000700,
 0.00000481,-0.00000025,-0.00000064,0.00000024,-0.00000332,0.00000188,0
 .00000034,-0.00000103,0.00000161,0.00000169,0.00000999,-0.00000198,0.0
 0000787,-0.00001814,-0.00000512,-0.00001265,-0.00000232,-0.00000237,-0
 .00000051,-0.00000411,0.00000535,0.00000346,-0.00000315,-0.00000017,-0
 .00000021,-0.00001542,-0.00000296,0.00000350,-0.00000299,-0.00000091,0
 .00000621,-0.00000158,0.00000135,0.00000078,-0.00000514,0.00000584,0.0
 0000332,0.00000432,-0.00000178,0.00000387,0.00000469,-0.00000122,0.000
 00421,0.00000501,-0.00000025,0.00000677\\\@


 IT IS BY EATING THE LIGHT OF A STAR THAT WE EXIST, 
 IN THE FINAL ANALYSIS, 
 JUST AS IT IS BY PERCEIVING THE LIGHT OF STARS
 THAT WE DEFINE THE WORLD AROUND US.

                                    -- GILBERT GROSVENOR
 Job cpu time:       0 days  5 hours  4 minutes 50.4 seconds.
 Elapsed time:       0 days  0 hours 38 minutes 22.7 seconds.
 File lengths (MBytes):  RWF=    292 Int=      0 D2E=      0 Chk=     13 Scr=      2
 Normal termination of Gaussian 16 at Fri Jul 16 13:48:28 2021.
